A0A087XIB2_POEFO Loading...

Beta-galactoside alpha-2,6-sialyltransferase 1

AlphaFold DB , UniProt , Accession A0A087XIB2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 507 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	Q	49.7	Very low	34.1	Very low	188 Å²	188	133.6 Å²	133.6	88%	0.879	74%	0.743	S	S	*	*				0	14.1	0	-64.2	-177.4	-23.1	0	0	113.3	F3	Q1-F3 VanDerWaalsContact CA-O 3.28Å; Q1-F3 WeakPolarHBondContact CA-O 3.27Å; Q1-F3 WeakPolarHBondContact CB-O 3.48Å; Q1-F3 VanDerWaalsContact CG-O 3.23Å; Q1-F3 WeakPolarHBondContact CG-O 3.24Å; Q1-F3 PolarHBondContact N-O 3.34Å
2	V	32.3	Very low	33.9	Very low	134 Å²	134	136.6 Å²	136.6	81%	0.812	76%	0.755	S	S	*	*				50	93.7	-100.3	176.3	0	0	0	0	107.6
3	F	30.6	Very low	33.7	Very low	158 Å²	158	138.5 Å²	138.5	69%	0.693	76%	0.755	S	S	*	*	S	Bend	trans	72.3	147.7	174.6	-77.9	-91.4	0	0	0	120.3	Q1	Q1-F3 VanDerWaalsContact CA-O 3.28Å; Q1-F3 WeakPolarHBondContact CA-O 3.27Å; Q1-F3 WeakPolarHBondContact CB-O 3.48Å; Q1-F3 VanDerWaalsContact CG-O 3.23Å; Q1-F3 WeakPolarHBondContact CG-O 3.24Å; Q1-F3 PolarHBondContact N-O 3.34Å
4	F	28.7	Very low	33.9	Very low	152 Å²	152	138.7 Å²	138.7	67%	0.667	75%	0.753	S	S	*	*			trans	85.6	82.8	-173.1	-58.7	-76.3	0	0	0	111.9	L6	F4-L6 HydrophobicContact CD1-CD1 4.42Å; F4-L6 HydrophobicContact CE1-CD1 4.41Å
5	S	33.1	Very low	34.4	Very low	86 Å²	86	137.7 Å²	137.7	60%	0.601	76%	0.756	S	S	*	*			cis	55	144.8	28.5	-161	0	0	0	0	113.8
6	L	29.6	Very low	34.1	Very low	128 Å²	128	133.6 Å²	133.6	67%	0.67	76%	0.756	S	S	*	*			trans	77.8	94.7	170.2	-65.5	123.4	0	0	0	114.4	F4	F4-L6 HydrophobicContact CD1-CD1 4.42Å; F4-L6 HydrophobicContact CE1-CD1 4.41Å
7	S	40.6	Very low	34.2	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	76%	0.762	S	S	*	*				57.9	104.5	69.5	-47.2	0	0	0	0	110.6
8	V	29.1	Very low	34.4	Very low	130 Å²	130	129.9 Å²	129.9	79%	0.788	76%	0.764	S	S	*	*			trans	-138.3	95.3	140.7	-176	0	0	0	0	107.6	L10	V8-L10 HydrophobicContact CG1-CB 4.43Å; V8-L10 HydrophobicContact CG1-CD1 4.41Å
9	S	38.9	Very low	34.4	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	77%	0.774	S	S	*	*			trans	-61.4	124.9	145.6	-65	0	0	0	0	107.1
10	L	28.9	Very low	34.7	Very low	157 Å²	157	132.8 Å²	132.8	82%	0.822	77%	0.768	S	S	*	*			trans	-130.9	113.8	149.4	-139.1	91.7	0	0	0	108.6	V8	V8-L10 HydrophobicContact CG1-CB 4.43Å; V8-L10 HydrophobicContact CG1-CD1 4.41Å
11	V	33.9	Very low	35.3	Very low	121 Å²	121	136.3 Å²	136.3	73%	0.733	77%	0.769	S	S	*	*			trans	-57.1	127.3	166.9	172	0	0	0	0	108.1	E13	V11-E13 HydrophobicContact CG1-CG 4.31Å
12	L	31.2	Very low	35.4	Very low	169 Å²	169	131.3 Å²	131.3	89%	0.885	75%	0.751	S	S	*	*			trans	-97.2	109.3	162.5	-99.6	154.9	0	0	0	107.1	I14	L12-I14 PolarHBondContact O-N 2.85Å
13	E	32.1	Very low	36.5	Very low	161 Å²	161	127.8 Å²	127.8	75%	0.752	73%	0.732	S	S	*	*			trans	-75.3	114.7	167	-83.3	-162.5	145.4	0	0	110.2	V11	V11-E13 HydrophobicContact CG1-CG 4.31Å
14	I	36.5	Very low	37.5	Very low	142 Å²	142	126.3 Å²	126.3	73%	0.728	73%	0.731	S	S	*	*				52.8	145.8	122.7	-55.1	172.5	0	0	0	117.9	L12	L12-I14 PolarHBondContact O-N 2.85Å
15	P	40.8	Very low	38.5	Very low	123 Å²	123	125.6 Å²	125.6	80%	0.799	73%	0.733	S	S	*	*			cis	-131.4	162.3	7.7	20.1	4.4	0	0	0	115.1
16	G	29.3	Very low	39.4	Very low	73 Å²	73	128.4 Å²	128.4	75%	0.753	73%	0.731	S	S	*	*			trans	164.2	91	161.9	0	0	0	0	0	114.7
17	A	36.3	Very low	40.6	Very low	104 Å²	104	129.7 Å²	129.7	86%	0.86	73%	0.726	S	S	*	*			trans	27.1	125.6	151.3	0	0	0	0	0	120.5
18	A	37.3	Very low	41	Very low	96 Å²	96	129.2 Å²	129.2	79%	0.793	72%	0.715	S	S	*	*			trans	109.3	121.8	137.5	0	0	0	0	0	118.7
19	M	34.6	Very low	42.2	Very low	194 Å²	194	131.2 Å²	131.2	96%	0.956	71%	0.709	S	S	*	*			trans	91.6	100.8	151.6	-61.5	-127	-71.1	0	0	119.1
20	D	40.3	Very low	43	Very low	123 Å²	123	132.4 Å²	132.4	66%	0.658	70%	0.696	S	S	*	*			trans	-88.1	155.1	-177.9	-159.6	2.7	0	0	0	111.4
21	R	48.1	Very low	44.3	Very low	208 Å²	208	133.9 Å²	133.9	79%	0.785	69%	0.69	S	S	*	*			trans	66.8	81.9	155.9	-43.2	-164.8	-177.2	180	1.9	121.1	S23	R21-S23 PolarHBondContact O-N 3.45Å
22	V	50.4	Low	45.3	Very low	83 Å²	83	131.1 Å²	131.1	50%	0.503	68%	0.681	S	S	.	*			trans	-82.9	105	133.3	-175.7	0	0	0	0	107.9	W26 R27	V22-W26 HydrophobicContact CG1-CB 3.86Å; V22-W26 HydrophobicContact CG1-CD2 4.17Å; V22-W26 HydrophobicContact CG1-CE3 3.81Å; V22-W26 HydrophobicContact CG1-CG 4.23Å; V22-R27 PolarHBondContact O-NH2 3.36Å
23	S	56.9	Low	46.6	Very low	60 Å²	60	130.9 Å²	130.9	42%	0.42	67%	0.668	S	S	.	*			trans	-54.8	143.8	-175.7	80.9	0	0	0	0	111.4	R21 L25 W26 R27	R21-S23 PolarHBondContact O-N 3.45Å; S23-L25 PolarHBondContact O-N 2.62Å; S23-L25 VanDerWaalsContact O-N 3.11Å; S23-W26 WeakPolarHBondContact O-CB 3.27Å; S23-W26 PolarHBondContact O-N 2.84Å; S23-W26 PolarHBondContact OG-N 3.23Å; S23-R27 PolarHBondContact O-N 3.05Å
24	L	51.1	Low	48.1	Very low	127 Å²	127	131 Å²	131	67%	0.665	66%	0.662	S	S	*	*	H	α-helix	trans	-50.2	-36.2	175.2	-166.9	81.3	0	0	0	111.3	W26 R27 L28	L24-W26 PolarHBondContact O-N 2.9Å; L24-R27 PolarHBondContact O-N 2.71Å; L24-L28 HydrophobicContact CD2-CD1 4.33Å; L24-L28 HydrophobicContact CG-CD1 4.17Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.01Å
25	L	50.2	Low	49.6	Very low	136 Å²	136	126 Å²	126	71%	0.712	65%	0.645	S	S	*	*	H	α-helix	trans	-58.1	-40.1	173.5	-83.3	156.1	0	0	0	113.2	S23 L28 R29	S23-L25 PolarHBondContact O-N 2.62Å; S23-L25 VanDerWaalsContact O-N 3.11Å; L25-L28 PolarHBondContact O-N 3.2Å; L25-R29 VanDerWaalsContact O-CB 3.26Å; L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 3.12Å
26	W	51.9	Low	50.9	Low	145 Å²	145	122.8 Å²	122.8	55%	0.549	63%	0.629	S	S	.	*	H	α-helix	trans	-69.7	-38.8	180	-154.4	93	0	0	0	112.1	V22 S23 L24 R29 R30	V22-W26 HydrophobicContact CG1-CB 3.86Å; V22-W26 HydrophobicContact CG1-CD2 4.17Å; V22-W26 HydrophobicContact CG1-CE3 3.81Å; V22-W26 HydrophobicContact CG1-CG 4.23Å; S23-W26 WeakPolarHBondContact O-CB 3.27Å; S23-W26 PolarHBondContact O-N 2.84Å; S23-W26 PolarHBondContact OG-N 3.23Å; L24-W26 PolarHBondContact O-N 2.9Å; W26-R29 PolarHBondContact O-N 2.99Å; W26-R30 WeakPolarHBondContact O-CB 3.38Å; W26-R30 PolarHBondContact O-N 3.46Å
27	R	54	Low	53	Low	155 Å²	155	123.9 Å²	123.9	59%	0.585	62%	0.616	S	S	*	*	H	α-helix	trans	-66.2	-41.5	173.5	-80.9	-177.8	-89.2	-163.1	-6.2	112.1	V22 S23 L24 R30 R31	V22-R27 PolarHBondContact O-NH2 3.36Å; S23-R27 PolarHBondContact O-N 3.05Å; L24-R27 PolarHBondContact O-N 2.71Å; R27-R30 PolarHBondContact O-N 3.4Å; R27-R31 WeakPolarHBondContact O-CB 3.01Å; R27-R31 PolarHBondContact O-N 2.87Å; R27-R31 VanDerWaalsContact O-N 3.1Å
28	L	50.1	Low	54.7	Low	92 Å²	92	123.1 Å²	123.1	48%	0.482	60%	0.603	S	S	.	*	H	α-helix	trans	-65.1	-42.1	174.7	-73.2	166.7	0	0	0	111.8	L24 L25 R30 R31 A32	L24-L28 HydrophobicContact CD2-CD1 4.33Å; L24-L28 HydrophobicContact CG-CD1 4.17Å; L24-L28 WeakPolarHBondContact O-CG 3.39Å; L24-L28 PolarHBondContact O-N 3.01Å; L25-L28 PolarHBondContact O-N 3.2Å; L28-R30 PolarHBondContact O-N 2.86Å; L28-R31 PolarHBondContact O-N 2.66Å; L28-A32 WeakPolarHBondContact O-CB 3.21Å; L28-A32 PolarHBondContact O-N 3.17Å
29	R	53.6	Low	56.5	Low	173 Å²	173	124 Å²	124	65%	0.653	59%	0.592	S	S	*	*	H	α-helix	trans	-65.8	-36.2	178.6	-148.7	174.1	-165.8	178.5	3.2	112.5	L25 W26 R33	L25-R29 VanDerWaalsContact O-CB 3.26Å; L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 3.12Å; W26-R29 PolarHBondContact O-N 2.99Å; R29-R33 WeakPolarHBondContact O-CB 3.36Å; R29-R33 WeakPolarHBondContact O-CG 3.02Å; R29-R33 PolarHBondContact O-N 3Å
30	R	54.9	Low	58.6	Low	138 Å²	138	118.6 Å²	118.6	52%	0.521	57%	0.571	S	S	.	*	H	α-helix	trans	-70.8	-37	175.1	-157.2	175.7	-168.5	-179.3	4.2	112.1	W26 R27 L28 R34	W26-R30 WeakPolarHBondContact O-CB 3.38Å; W26-R30 PolarHBondContact O-N 3.46Å; R27-R30 PolarHBondContact O-N 3.4Å; L28-R30 PolarHBondContact O-N 2.86Å; R30-R34 WeakPolarHBondContact O-CG 3.36Å; R30-R34 PolarHBondContact O-N 3.2Å; R30-R34 VanDerWaalsContact O-N 3.07Å
31	R	57.2	Low	60.4	Low	188 Å²	188	119.3 Å²	119.3	71%	0.709	57%	0.568	S	S	*	*	H	α-helix	trans	-70.4	-39.3	174.8	-160.6	176.9	-81	157.3	-7.7	111.6	R27 L28 R34 G35	R27-R31 WeakPolarHBondContact O-CB 3.01Å; R27-R31 PolarHBondContact O-N 2.87Å; R27-R31 VanDerWaalsContact O-N 3.1Å; L28-R31 PolarHBondContact O-N 2.66Å; R31-R34 PolarHBondContact O-N 3.37Å; R31-G35 PolarHBondContact O-N 2.89Å
32	A	54.1	Low	61.7	Low	64 Å²	64	115.1 Å²	115.1	53%	0.529	56%	0.556	S	S	.	*	H	α-helix	trans	-66.3	-41.4	173.1	0	0	0	0	0	112.8	L28 G35 A36	L28-A32 WeakPolarHBondContact O-CB 3.21Å; L28-A32 PolarHBondContact O-N 3.17Å; A32-G35 PolarHBondContact O-N 2.96Å; A32-A36 WeakPolarHBondContact O-CB 3.43Å; A32-A36 PolarHBondContact O-N 2.77Å
33	R	58.9	Low	63	Low	164 Å²	164	114.6 Å²	114.6	62%	0.619	56%	0.555	S	S	*	*	H	α-helix	trans	-64.1	-40.2	174	-80.2	-176.7	-172.4	-177.9	2.4	112.6	R29 A36 I37	R29-R33 WeakPolarHBondContact O-CB 3.36Å; R29-R33 WeakPolarHBondContact O-CG 3.02Å; R29-R33 PolarHBondContact O-N 3Å; R33-A36 PolarHBondContact O-N 3.11Å; R33-I37 WeakPolarHBondContact O-CB 3.31Å; R33-I37 WeakPolarHBondContact O-CD1 3.06Å; R33-I37 VanDerWaalsContact O-CG1 3.24Å; R33-I37 WeakPolarHBondContact O-CG1 3.48Å; R33-I37 PolarHBondContact O-N 2.85Å
34	R	63.8	Low	64.4	Low	164 Å²	164	116 Å²	116	62%	0.619	56%	0.557	S	S	*	*	H	α-helix	trans	-64.9	-41.3	173.6	-75.6	179.9	178.6	-179.2	-1.4	111.6	R30 R31 I37 C38	R30-R34 WeakPolarHBondContact O-CG 3.36Å; R30-R34 PolarHBondContact O-N 3.2Å; R30-R34 VanDerWaalsContact O-N 3.07Å; R31-R34 PolarHBondContact O-N 3.37Å; R34-I37 PolarHBondContact O-N 2.97Å; R34-C38 WeakPolarHBondContact O-CB 3.48Å; R34-C38 PolarHBondContact O-N 2.98Å; R34-C38 PolarHBondContact O-SG 2.97Å
35	G	67.1	Low	65.7	Low	37 Å²	37	113.4 Å²	113.4	38%	0.381	55%	0.55	S	S	.	.	H	α-helix	trans	-61.3	-43.4	173.4	0	0	0	0	0	113.1	R31 A32 C38 M39	R31-G35 PolarHBondContact O-N 2.89Å; A32-G35 PolarHBondContact O-N 2.96Å; G35-C38 PolarHBondContact O-N 2.9Å; G35-M39 WeakPolarHBondContact O-CB 3.47Å; G35-M39 WeakPolarHBondContact O-CG 3.31Å; G35-M39 PolarHBondContact O-N 2.89Å
36	A	68.8	Low	67.3	Low	55 Å²	55	108.6 Å²	108.6	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-64.3	-43.5	176.6	0	0	0	0	0	112.1	A32 R33 M39 T40	A32-A36 WeakPolarHBondContact O-CB 3.43Å; A32-A36 PolarHBondContact O-N 2.77Å; R33-A36 PolarHBondContact O-N 3.11Å; A36-M39 PolarHBondContact O-N 3.27Å; A36-T40 PolarHBondContact O-N 2.97Å; A36-T40 PolarHBondContact O-OG1 3.25Å
37	I	74.4	Confident	68.7	Low	96 Å²	96	104.6 Å²	104.6	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-63.4	-45.2	176.7	-68.9	165.2	0	0	0	110.7	R33 R34 M39 T40 F41	R33-I37 WeakPolarHBondContact O-CB 3.31Å; R33-I37 WeakPolarHBondContact O-CD1 3.06Å; R33-I37 VanDerWaalsContact O-CG1 3.24Å; R33-I37 WeakPolarHBondContact O-CG1 3.48Å; R33-I37 PolarHBondContact O-N 2.85Å; R34-I37 PolarHBondContact O-N 2.97Å; I37-M39 VanDerWaalsContact C-N 3.33Å; I37-M39 PolarHBondContact O-N 3.23Å; I37-T40 PolarHBondContact O-N 3.25Å; I37-F41 HydrophobicContact CG2-CD2 3.69Å; I37-F41 HydrophobicContact CG2-CE2 3.67Å; I37-F41 VanDerWaalsContact O-CD2 3.28Å; I37-F41 WeakPolarHBondContact O-CD2 3.42Å; I37-F41 PolarHBondContact O-N 2.86Å
38	C	71.1	Confident	70.1	Confident	87 Å²	87	102 Å²	102	59%	0.588	52%	0.518	S	S	*	.	H	α-helix	trans	-62	-39.7	176	-70	0	0	0	0	112.3	R34 G35 F41 F42	R34-C38 WeakPolarHBondContact O-CB 3.48Å; R34-C38 PolarHBondContact O-N 2.98Å; R34-C38 PolarHBondContact O-SG 2.97Å; G35-C38 PolarHBondContact O-N 2.9Å; C38-F41 PolarHBondContact O-N 3.04Å; C38-F42 WeakPolarHBondContact O-CB 3.23Å; C38-F42 PolarHBondContact O-N 3.47Å
39	M	74.9	Confident	71.3	Confident	114 Å²	114	99.9 Å²	99.9	56%	0.562	51%	0.508	S	S	*	.	H	α-helix	trans	-66	-40.8	174.8	-77.4	-60.9	-65	0	0	112.2	G35 A36 I37 F42 C43	G35-M39 WeakPolarHBondContact O-CB 3.47Å; G35-M39 WeakPolarHBondContact O-CG 3.31Å; G35-M39 PolarHBondContact O-N 2.89Å; A36-M39 PolarHBondContact O-N 3.27Å; I37-M39 VanDerWaalsContact C-N 3.33Å; I37-M39 PolarHBondContact O-N 3.23Å; M39-F42 PolarHBondContact O-N 3.35Å; M39-C43 WeakPolarHBondContact O-CB 3.19Å; M39-C43 PolarHBondContact O-N 3.12Å; M39-C43 PolarHBondContact O-SG 3.42Å
40	T	78.3	Confident	72.4	Confident	81 Å²	81	98.1 Å²	98.1	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-45.5	175.9	-57	0	0	0	0	111.3	A36 I37 F42 C43 I44	A36-T40 PolarHBondContact O-N 2.97Å; A36-T40 PolarHBondContact O-OG1 3.25Å; I37-T40 PolarHBondContact O-N 3.25Å; T40-F42 PolarHBondContact O-N 2.98Å; T40-C43 PolarHBondContact O-N 2.69Å; T40-I44 HydrophobicContact CG2-CD1 3.92Å; T40-I44 VanDerWaalsContact O-CG1 3.3Å; T40-I44 WeakPolarHBondContact O-CG1 3.46Å; T40-I44 PolarHBondContact O-N 3.24Å
41	F	78.4	Confident	73.3	Confident	138 Å²	138	94.3 Å²	94.3	61%	0.605	50%	0.5	S	S	*	.	H	α-helix	trans	-62.5	-42.1	174.8	-84.2	-70.4	0	0	0	111.9	I37 C38 C43 I44 S45	I37-F41 HydrophobicContact CG2-CD2 3.69Å; I37-F41 HydrophobicContact CG2-CE2 3.67Å; I37-F41 VanDerWaalsContact O-CD2 3.28Å; I37-F41 WeakPolarHBondContact O-CD2 3.42Å; I37-F41 PolarHBondContact O-N 2.86Å; C38-F41 PolarHBondContact O-N 3.04Å; F41-C43 PolarHBondContact O-N 2.8Å; F41-I44 PolarHBondContact O-N 3.2Å; F41-S45 WeakPolarHBondContact O-CB 3.37Å; F41-S45 PolarHBondContact O-N 3.4Å; F41-S45 PolarHBondContact O-OG 3.23Å; F41-S45 VanDerWaalsContact O-OG 3.06Å
42	F	76.6	Confident	73.9	Confident	121 Å²	121	89.6 Å²	89.6	53%	0.531	49%	0.488	S	S	.	.	H	α-helix	trans	-59.9	-45.1	174.9	178.7	-98.2	0	0	0	112.1	C38 M39 T40 S45 M46	C38-F42 WeakPolarHBondContact O-CB 3.23Å; C38-F42 PolarHBondContact O-N 3.47Å; M39-F42 PolarHBondContact O-N 3.35Å; T40-F42 PolarHBondContact O-N 2.98Å; F42-S45 PolarHBondContact O-N 3.2Å; F42-M46 HydrophobicContact CD1-CG 4.26Å; F42-M46 HydrophobicContact CD2-CG 4.45Å; F42-M46 HydrophobicContact CE1-CG 3.83Å; F42-M46 HydrophobicContact CE2-CG 4.04Å; F42-M46 HydrophobicContact CZ-CG 3.71Å; F42-M46 HydrophobicContact CZ-SD 4.32Å; F42-M46 VanDerWaalsContact O-CB 3.3Å; F42-M46 WeakPolarHBondContact O-CB 3.37Å; F42-M46 WeakPolarHBondContact O-CG 3.41Å; F42-M46 PolarHBondContact O-N 2.93Å
43	C	76.6	Confident	74.5	Confident	71 Å²	71	87 Å²	87	48%	0.48	47%	0.466	S	S	.	.	H	α-helix	trans	-63.8	-41.6	177.2	-70.3	0	0	0	0	112.4	M39 T40 F41 M46 A47	M39-C43 WeakPolarHBondContact O-CB 3.19Å; M39-C43 PolarHBondContact O-N 3.12Å; M39-C43 PolarHBondContact O-SG 3.42Å; T40-C43 PolarHBondContact O-N 2.69Å; F41-C43 PolarHBondContact O-N 2.8Å; C43-M46 PolarHBondContact O-N 3.48Å; C43-A47 WeakPolarHBondContact O-CB 3.27Å; C43-A47 PolarHBondContact O-N 2.69Å
44	I	85.6	Confident	74.8	Confident	90 Å²	90	82.8 Å²	82.8	46%	0.462	47%	0.466	S	S	.	.	H	α-helix	trans	-65.6	-46.2	176.8	-68.4	168	0	0	0	110.5	T40 F41 M46 A47 L48	T40-I44 HydrophobicContact CG2-CD1 3.92Å; T40-I44 VanDerWaalsContact O-CG1 3.3Å; T40-I44 WeakPolarHBondContact O-CG1 3.46Å; T40-I44 PolarHBondContact O-N 3.24Å; F41-I44 PolarHBondContact O-N 3.2Å; I44-M46 VanDerWaalsContact C-N 3.33Å; I44-M46 PolarHBondContact O-N 3.09Å; I44-A47 PolarHBondContact O-N 3.09Å; I44-L48 HydrophobicContact CG2-CD1 4.01Å; I44-L48 WeakPolarHBondContact O-CB 3.49Å; I44-L48 PolarHBondContact O-N 3.22Å
45	S	78.9	Confident	75.2	Confident	73 Å²	73	81.2 Å²	81.2	51%	0.51	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-40.4	176.8	-64.7	0	0	0	0	112	F41 F42 L48 L49	F41-S45 WeakPolarHBondContact O-CB 3.37Å; F41-S45 PolarHBondContact O-N 3.4Å; F41-S45 PolarHBondContact O-OG 3.23Å; F41-S45 VanDerWaalsContact O-OG 3.06Å; F42-S45 PolarHBondContact O-N 3.2Å; S45-L48 PolarHBondContact O-N 2.77Å; S45-L49 WeakPolarHBondContact O-CB 3.37Å; S45-L49 PolarHBondContact O-N 3.14Å
46	M	83.5	Confident	75.1	Confident	35 Å²	35	84.6 Å²	84.6	17%	0.172	48%	0.475	C	S	.	.	H	α-helix	trans	-66.4	-43.1	174.9	-80.8	-56.6	-46.8	0	0	111.9	F42 C43 I44 L48 L49 Y50 V60 I64	F42-M46 HydrophobicContact CD1-CG 4.26Å; F42-M46 HydrophobicContact CD2-CG 4.45Å; F42-M46 HydrophobicContact CE1-CG 3.83Å; F42-M46 HydrophobicContact CE2-CG 4.04Å; F42-M46 HydrophobicContact CZ-CG 3.71Å; F42-M46 HydrophobicContact CZ-SD 4.32Å; F42-M46 VanDerWaalsContact O-CB 3.3Å; F42-M46 WeakPolarHBondContact O-CB 3.37Å; F42-M46 WeakPolarHBondContact O-CG 3.41Å; F42-M46 PolarHBondContact O-N 2.93Å; C43-M46 PolarHBondContact O-N 3.48Å; I44-M46 VanDerWaalsContact C-N 3.33Å; I44-M46 PolarHBondContact O-N 3.09Å; M46-L48 VanDerWaalsContact C-N 3.35Å; M46-L48 PolarHBondContact O-N 3.4Å; M46-L49 HydrophobicContact CE-CD2 4.19Å; M46-L49 WeakPolarHBondContact O-CB 3.38Å; M46-L49 PolarHBondContact O-N 3.35Å; M46-L49 HydrophobicContact SD-CD2 4.09Å; M46-Y50 HydrophobicContact CE-CD2 3.77Å; M46-Y50 HydrophobicContact CE-CE2 3.22Å; M46-Y50 WeakPolarHBondContact O-CD2 3.43Å; M46-Y50 PolarHBondContact O-N 3.22Å; M46-V60 HydrophobicContact CE-CG1 4.1Å; M46-I64 HydrophobicContact CE-CD1 3.99Å; M46-I64 HydrophobicContact SD-CD1 4.12Å
47	A	80.9	Confident	75.1	Confident	60 Å²	60	85.9 Å²	85.9	50%	0.496	48%	0.481	S	S	.	.	H	α-helix	trans	-61.8	-42	176.7	0	0	0	0	0	112	C43 I44 Y50 A51	C43-A47 WeakPolarHBondContact O-CB 3.27Å; C43-A47 PolarHBondContact O-N 2.69Å; I44-A47 PolarHBondContact O-N 3.09Å; A47-Y50 PolarHBondContact O-N 3.19Å; A47-A51 WeakPolarHBondContact O-CB 3.43Å; A47-A51 PolarHBondContact O-N 3.38Å
48	L	83.9	Confident	74.9	Confident	100 Å²	100	84.4 Å²	84.4	52%	0.524	48%	0.476	S	S	.	.	H	α-helix	trans	-61.6	-43.3	172.3	-87.1	157.1	0	0	0	111.8	I44 S45 M46 A51 L52	I44-L48 HydrophobicContact CG2-CD1 4.01Å; I44-L48 WeakPolarHBondContact O-CB 3.49Å; I44-L48 PolarHBondContact O-N 3.22Å; S45-L48 PolarHBondContact O-N 2.77Å; M46-L48 VanDerWaalsContact C-N 3.35Å; M46-L48 PolarHBondContact O-N 3.4Å; L48-A51 PolarHBondContact O-N 2.98Å; L48-L52 WeakPolarHBondContact O-CB 3.45Å; L48-L52 WeakPolarHBondContact O-CG 3.14Å; L48-L52 PolarHBondContact O-N 2.91Å
49	L	75.9	Confident	74.8	Confident	49 Å²	49	83.6 Å²	83.6	26%	0.257	47%	0.47	S	S	.	.	H	α-helix	trans	-62.2	-43.6	176.4	-175.7	65.8	0	0	0	111.6	S45 M46 L52 C53 V60 A63 I64	S45-L49 WeakPolarHBondContact O-CB 3.37Å; S45-L49 PolarHBondContact O-N 3.14Å; M46-L49 HydrophobicContact CE-CD2 4.19Å; M46-L49 WeakPolarHBondContact O-CB 3.38Å; M46-L49 PolarHBondContact O-N 3.35Å; M46-L49 HydrophobicContact SD-CD2 4.09Å; L49-L52 PolarHBondContact O-N 2.94Å; L49-C53 WeakPolarHBondContact O-CB 3.42Å; L49-C53 PolarHBondContact O-N 3.41Å; L49-C53 PolarHBondContact O-SG 3.2Å; L49-V60 HydrophobicContact CD2-CG1 4.04Å; L49-V60 HydrophobicContact CG-CG1 4.34Å; L49-A63 HydrophobicContact CD1-CB 4.14Å; L49-I64 HydrophobicContact CD2-CD1 3.85Å; L49-I64 HydrophobicContact CD2-CG1 3.56Å
50	Y	76.3	Confident	74.4	Confident	136 Å²	136	79.1 Å²	79.1	53%	0.533	45%	0.449	S	S	.	.	H	α-helix	trans	-62.1	-42.8	175	-84.9	-74.4	0	0	0	111.9	M46 A47 C53 A54 V60	M46-Y50 HydrophobicContact CE-CD2 3.77Å; M46-Y50 HydrophobicContact CE-CE2 3.22Å; M46-Y50 WeakPolarHBondContact O-CD2 3.43Å; M46-Y50 PolarHBondContact O-N 3.22Å; A47-Y50 PolarHBondContact O-N 3.19Å; Y50-C53 PolarHBondContact O-N 3.31Å; Y50-A54 VanDerWaalsContact O-CB 3.26Å; Y50-A54 WeakPolarHBondContact O-CB 3.23Å; Y50-A54 PolarHBondContact O-N 3.38Å; Y50-V60 HydrophobicContact CD1-CB 4.17Å; Y50-V60 HydrophobicContact CD1-CG1 4.34Å; Y50-V60 HydrophobicContact CD1-CG2 3.28Å; Y50-V60 HydrophobicContact CE1-CB 3.78Å; Y50-V60 HydrophobicContact CE1-CG1 3.91Å; Y50-V60 HydrophobicContact CE1-CG2 3.39Å; Y50-V60 HydrophobicContact CE2-CG1 4.38Å; Y50-V60 HydrophobicContact CG-CG2 4Å
51	A	74.1	Confident	73.8	Confident	57 Å²	57	78.9 Å²	78.9	47%	0.471	45%	0.448	S	S	.	.	H	α-helix	trans	-63.8	-47.1	177.5	0	0	0	0	0	111.9	A47 L48 C53 A54 E55	A47-A51 WeakPolarHBondContact O-CB 3.43Å; A47-A51 PolarHBondContact O-N 3.38Å; L48-A51 PolarHBondContact O-N 2.98Å; A51-C53 PolarHBondContact O-N 2.88Å; A51-A54 PolarHBondContact O-N 2.81Å; A51-E55 WeakPolarHBondContact O-CB 3.46Å; A51-E55 PolarHBondContact O-N 2.82Å
52	L	68.7	Low	73.1	Confident	90 Å²	90	73.7 Å²	73.7	47%	0.471	43%	0.426	S	S	.	.	H	α-helix	trans	-64.6	-39.2	177.3	-72.8	168.4	0	0	0	112.3	L48 L49 E55 N56	L48-L52 WeakPolarHBondContact O-CB 3.45Å; L48-L52 WeakPolarHBondContact O-CG 3.14Å; L48-L52 PolarHBondContact O-N 2.91Å; L49-L52 PolarHBondContact O-N 2.94Å; L52-E55 PolarHBondContact O-N 3.31Å; L52-N56 WeakPolarHBondContact O-CB 3.38Å; L52-N56 PolarHBondContact O-N 2.87Å; L52-N56 VanDerWaalsContact O-N 3.08Å; L52-N56 PolarHBondContact O-ND2 3.48Å
53	C	68.3	Low	72.6	Confident	9 Å²	9	70.4 Å²	70.4	6%	0.061	42%	0.421	C	S	.	.	H	α-helix	trans	-68.3	-38.6	176.4	-74.2	0	0	0	0	112	L49 Y50 A51 N56 S57 V58 V60	L49-C53 WeakPolarHBondContact O-CB 3.42Å; L49-C53 PolarHBondContact O-N 3.41Å; L49-C53 PolarHBondContact O-SG 3.2Å; Y50-C53 PolarHBondContact O-N 3.31Å; A51-C53 PolarHBondContact O-N 2.88Å; C53-N56 PolarHBondContact O-N 2.87Å; C53-S57 WeakPolarHBondContact O-CA 3.29Å; C53-S57 PolarHBondContact O-N 2.64Å; C53-V58 VanDerWaalsContact CB-O 3.28Å; C53-V58 WeakPolarHBondContact CB-O 3.22Å; C53-V58 PolarHBondContact O-N 3Å; C53-V60 HydrophobicContact CB-CG2 3.58Å
54	A	65.7	Low	71.9	Confident	76 Å²	76	70.7 Å²	70.7	63%	0.628	42%	0.417	S	S	*	.	H	α-helix	trans	-65.7	-40.3	174.2	0	0	0	0	0	111.9	Y50 A51 N56 S57	Y50-A54 VanDerWaalsContact O-CB 3.26Å; Y50-A54 WeakPolarHBondContact O-CB 3.23Å; Y50-A54 PolarHBondContact O-N 3.38Å; A51-A54 PolarHBondContact O-N 2.81Å; A54-N56 VanDerWaalsContact C-N 3.33Å; A54-N56 PolarHBondContact O-N 3.2Å; A54-S57 PolarHBondContact O-N 3.05Å
55	E	70.8	Confident	70.6	Confident	130 Å²	130	73.6 Å²	73.6	61%	0.607	43%	0.427	S	S	*	.	H	α-helix	trans	-66.8	-34.4	178.2	-171.2	169.5	-165.4	0	0	112.7	A51 L52	A51-E55 WeakPolarHBondContact O-CB 3.46Å; A51-E55 PolarHBondContact O-N 2.82Å; L52-E55 PolarHBondContact O-N 3.31Å
56	N	64.6	Low	69.3	Low	108 Å²	108	71.8 Å²	71.8	58%	0.578	42%	0.419	S	S	*	.	H	α-helix	trans	-98.2	2.8	-178.8	-65.1	-59.6	0	0	0	114.2	L52 C53 A54 V58	L52-N56 WeakPolarHBondContact O-CB 3.38Å; L52-N56 PolarHBondContact O-N 2.87Å; L52-N56 VanDerWaalsContact O-N 3.08Å; L52-N56 PolarHBondContact O-ND2 3.48Å; C53-N56 PolarHBondContact O-N 2.87Å; A54-N56 VanDerWaalsContact C-N 3.33Å; A54-N56 PolarHBondContact O-N 3.2Å; N56-V58 VanDerWaalsContact C-N 3.25Å; N56-V58 HydrophobicContact CB-CG2 4.28Å; N56-V58 PolarHBondContact O-N 2.9Å
57	S	69.4	Low	67.8	Low	82 Å²	82	75.4 Å²	75.4	57%	0.573	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	33.7	-178.4	-52	0	0	0	0	114.5	C53 A54	C53-S57 WeakPolarHBondContact O-CA 3.29Å; C53-S57 PolarHBondContact O-N 2.64Å; A54-S57 PolarHBondContact O-N 3.05Å
58	V	70.1	Confident	66.1	Low	65 Å²	65	83.9 Å²	83.9	39%	0.394	46%	0.462	S	S	.	.			trans	-102.4	133.9	176.7	-179.9	0	0	0	0	109.3	C53 N56 V60 D62	C53-V58 VanDerWaalsContact CB-O 3.28Å; C53-V58 WeakPolarHBondContact CB-O 3.22Å; C53-V58 PolarHBondContact O-N 3Å; N56-V58 VanDerWaalsContact C-N 3.25Å; N56-V58 HydrophobicContact CB-CG2 4.28Å; N56-V58 PolarHBondContact O-N 2.9Å; V58-V60 PolarHBondContact O-N 2.85Å; V58-D62 HydrophobicContact CG1-CB 4.27Å
59	P	69.9	Low	64	Low	71 Å²	71	81.9 Å²	81.9	46%	0.461	46%	0.46	S	S	.	.			trans	-64.2	131.7	172.9	-19.3	32	0	0	0	110.7	T61 D62 A63	P59-T61 PolarHBondContact O-N 2.88Å; P59-D62 WeakPolarHBondContact CG-OD2 3.44Å; P59-D62 WeakPolarHBondContact O-CB 3.41Å; P59-D62 PolarHBondContact O-N 3.37Å; P59-A63 PolarHBondContact O-N 3.12Å
60	V	65.3	Low	62.4	Low	19 Å²	19	86.3 Å²	86.3	12%	0.115	47%	0.473	C	S	.	.	H	α-helix	trans	-56.5	-30.9	-179.1	177.6	0	0	0	0	112.7	M46 L49 Y50 C53 V58 D62 A63 I64	M46-V60 HydrophobicContact CE-CG1 4.1Å; L49-V60 HydrophobicContact CD2-CG1 4.04Å; L49-V60 HydrophobicContact CG-CG1 4.34Å; Y50-V60 HydrophobicContact CD1-CB 4.17Å; Y50-V60 HydrophobicContact CD1-CG1 4.34Å; Y50-V60 HydrophobicContact CD1-CG2 3.28Å; Y50-V60 HydrophobicContact CE1-CB 3.78Å; Y50-V60 HydrophobicContact CE1-CG1 3.91Å; Y50-V60 HydrophobicContact CE1-CG2 3.39Å; Y50-V60 HydrophobicContact CE2-CG1 4.38Å; Y50-V60 HydrophobicContact CG-CG2 4Å; C53-V60 HydrophobicContact CB-CG2 3.58Å; V58-V60 PolarHBondContact O-N 2.85Å; V60-D62 VanDerWaalsContact C-N 3.27Å; V60-D62 PolarHBondContact O-N 3.3Å; V60-A63 PolarHBondContact O-N 2.86Å; V60-I64 HydrophobicContact CG1-CD1 3.65Å; V60-I64 HydrophobicContact CG1-CG1 4.22Å; V60-I64 WeakPolarHBondContact O-CG1 3.26Å; V60-I64 PolarHBondContact O-N 3.14Å; V60-I64 VanDerWaalsContact O-N 3.08Å
61	T	65.4	Low	60.6	Low	77 Å²	77	86.3 Å²	86.3	47%	0.472	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-34.3	174.4	55.3	0	0	0	0	113.1	P59 F65 R70	P59-T61 PolarHBondContact O-N 2.88Å; T61-F65 PolarHBondContact O-N 2.95Å; T61-F65 VanDerWaalsContact O-N 3.13Å; T61-R70 PolarHBondContact OG1-NH2 2.6Å
62	D	64.8	Low	58.9	Low	28 Å²	28	95 Å²	95	15%	0.15	51%	0.508	C	S	.	.	H	α-helix	trans	-76.2	-32.5	178.7	-74.8	-44.6	0	0	0	111.9	V58 P59 V60 G66 R70	V58-D62 HydrophobicContact CG1-CB 4.27Å; P59-D62 WeakPolarHBondContact CG-OD2 3.44Å; P59-D62 WeakPolarHBondContact O-CB 3.41Å; P59-D62 PolarHBondContact O-N 3.37Å; V60-D62 VanDerWaalsContact C-N 3.27Å; V60-D62 PolarHBondContact O-N 3.3Å; D62-G66 WeakPolarHBondContact O-CA 3.46Å; D62-G66 PolarHBondContact O-N 2.79Å; D62-G66 VanDerWaalsContact O-N 3.16Å; D62-R70 IonicContact OD1-CZ 3.89Å; D62-R70 IonicContact OD1-NE 2.72Å; D62-R70 IonicContact OD1-NH1 3.53Å; D62-R70 PolarHBondContact OD1-NH1 2.92Å; D62-R70 IonicContact OD1-NH2 2.67Å; D62-R70 PolarHBondContact OD1-NH2 3.47Å; D62-R70 IonicContact OD2-CZ 2.78Å; D62-R70 IonicContact OD2-NH1 3.85Å; D62-R70 PolarHBondContact OD2-NH1 3.43Å; D62-R70 IonicContact OD2-NH2 2.98Å; D62-R70 PolarHBondContact OD2-NH2 3.04Å
63	A	65.8	Low	57.2	Low	52 Å²	52	95 Å²	95	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-71.1	-31.8	174.9	0	0	0	0	0	113.1	L49 P59 V60	L49-A63 HydrophobicContact CD1-CB 4.14Å; P59-A63 PolarHBondContact O-N 3.12Å; V60-A63 PolarHBondContact O-N 2.86Å
64	I	62	Low	55.5	Low	78 Å²	78	103.1 Å²	103.1	40%	0.4	56%	0.558	S	S	.	*	H	α-helix	trans	-85.7	-44.1	-178.2	-64.2	173.6	0	0	0	112.3	M46 L49 V60	M46-I64 HydrophobicContact CE-CD1 3.99Å; M46-I64 HydrophobicContact SD-CD1 4.12Å; L49-I64 HydrophobicContact CD2-CD1 3.85Å; L49-I64 HydrophobicContact CD2-CG1 3.56Å; V60-I64 HydrophobicContact CG1-CD1 3.65Å; V60-I64 HydrophobicContact CG1-CG1 4.22Å; V60-I64 WeakPolarHBondContact O-CG1 3.26Å; V60-I64 PolarHBondContact O-N 3.14Å; V60-I64 VanDerWaalsContact O-N 3.08Å
65	F	58.3	Low	53.9	Low	151 Å²	151	105.2 Å²	105.2	66%	0.662	57%	0.565	S	S	*	*	H	α-helix	trans	-106	-9	-169.2	-63.6	-71.9	0	0	0	114.3	T61 A69	T61-F65 PolarHBondContact O-N 2.95Å; T61-F65 VanDerWaalsContact O-N 3.13Å; F65-A69 HydrophobicContact CB-CB 4.36Å; F65-A69 WeakPolarHBondContact O-CB 3.49Å
66	G	51.9	Low	51.9	Low	34 Å²	34	110.3 Å²	110.3	35%	0.351	58%	0.579	S	S	.	*			trans	68	147.1	-174.5	0	0	0	0	0	112.6	D62 R68 A69	D62-G66 WeakPolarHBondContact O-CA 3.46Å; D62-G66 PolarHBondContact O-N 2.79Å; D62-G66 VanDerWaalsContact O-N 3.16Å; G66-R68 PolarHBondContact O-N 2.86Å; G66-A69 PolarHBondContact O-N 3.42Å
67	V	52.4	Low	50.2	Low	111 Å²	111	111.5 Å²	111.5	67%	0.673	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-60.7	-21.8	-172	-174.4	0	0	0	0	113.3
68	R	44.1	Very low	48.4	Very low	239 Å²	239	116 Å²	116	90%	0.902	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-81.7	-11.6	-177.5	-102.7	179.2	178.3	174.2	-0	115.7	G66	G66-R68 PolarHBondContact O-N 2.86Å
69	A	40.7	Very low	46.4	Very low	57 Å²	57	117.9 Å²	117.9	47%	0.471	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-82.5	-12.1	-177.9	0	0	0	0	0	114.2	F65 G66 T71	F65-A69 HydrophobicContact CB-CB 4.36Å; F65-A69 WeakPolarHBondContact O-CB 3.49Å; G66-A69 PolarHBondContact O-N 3.42Å; A69-T71 VanDerWaalsContact C-N 3.3Å; A69-T71 PolarHBondContact O-N 2.96Å
70	R	42.4	Very low	44.6	Very low	143 Å²	143	120.8 Å²	120.8	54%	0.54	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-70.5	-14.4	-177.6	-81.1	-172.4	-175.8	130.8	0.7	115.4	T61 D62 R72	T61-R70 PolarHBondContact OG1-NH2 2.6Å; D62-R70 IonicContact OD1-CZ 3.89Å; D62-R70 IonicContact OD1-NE 2.72Å; D62-R70 IonicContact OD1-NH1 3.53Å; D62-R70 PolarHBondContact OD1-NH1 2.92Å; D62-R70 IonicContact OD1-NH2 2.67Å; D62-R70 PolarHBondContact OD1-NH2 3.47Å; D62-R70 IonicContact OD2-CZ 2.78Å; D62-R70 IonicContact OD2-NH1 3.85Å; D62-R70 PolarHBondContact OD2-NH1 3.43Å; D62-R70 IonicContact OD2-NH2 2.98Å; D62-R70 PolarHBondContact OD2-NH2 3.04Å; R70-R72 PolarHBondContact O-N 3.37Å
71	T	38.9	Very low	42.9	Very low	135 Å²	135	127.3 Å²	127.3	83%	0.828	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-87	0.9	-175.2	50.8	0	0	0	0	114.9	A69	A69-T71 VanDerWaalsContact C-N 3.3Å; A69-T71 PolarHBondContact O-N 2.96Å
72	R	36.7	Very low	41.1	Very low	240 Å²	240	133 Å²	133	91%	0.906	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-114.1	1.1	-174.4	-136.2	176.2	-173.7	169.3	1.4	116.3	R70	R70-R72 PolarHBondContact O-N 3.37Å
73	A	34.7	Very low	39.3	Very low	89 Å²	89	137.8 Å²	137.8	74%	0.736	72%	0.715	S	S	*	*			trans	-136.8	77.7	177.6	0	0	0	0	0	111.2
74	Q	31.8	Very low	37.6	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	74%	0.739	S	S	*	*			trans	-118.8	133.8	153.2	-87.6	-167	-35.3	0	0	108.8
75	P	31.1	Very low	35.8	Very low	120 Å²	120	151.7 Å²	151.7	78%	0.779	76%	0.764	S	S	*	*			trans	-70.6	133.4	176.2	28.4	-31.1	0	0	0	110.2	T77	P75-T77 PolarHBondContact O-N 3.34Å
76	R	28.9	Very low	34.3	Very low	237 Å²	237	148.5 Å²	148.5	89%	0.894	77%	0.773	S	S	*	*			trans	-65.4	112.9	175.4	-70.4	179.5	171.5	175.9	-2.8	110
77	T	30	Very low	33	Very low	133 Å²	133	151 Å²	151	82%	0.816	80%	0.798	S	S	*	*			trans	-95	119	156.9	48.9	0	0	0	0	108.4	P75 S79	P75-T77 PolarHBondContact O-N 3.34Å; T77-S79 PolarHBondContact O-N 3.38Å
78	H	31.1	Very low	31.9	Very low	175 Å²	175	150.3 Å²	150.3	81%	0.81	81%	0.805	S	S	*	*			trans	-64.3	123.2	178.2	-83.2	-103.5	0	0	0	111.2
79	S	28.2	Very low	31.1	Very low	105 Å²	105	148.1 Å²	148.1	73%	0.734	80%	0.802	S	S	*	*			trans	-136.6	115.6	152.4	59.2	0	0	0	0	108.2	T77 I81	T77-S79 PolarHBondContact O-N 3.38Å; S79-I81 PolarHBondContact O-N 3.43Å
80	V	31.7	Very low	30.3	Very low	133 Å²	133	151 Å²	151	81%	0.806	82%	0.819	S	S	*	*			trans	-66.5	117.6	-179.1	173.6	0	0	0	0	109.7
81	I	29	Very low	29.7	Very low	156 Å²	156	151.1 Å²	151.1	80%	0.8	83%	0.829	S	S	*	*			trans	-136.2	124	157.3	-59.5	-177.9	0	0	0	108.1	S79	S79-I81 PolarHBondContact O-N 3.43Å
82	K	28.9	Very low	29.1	Very low	197 Å²	197	155.1 Å²	155.1	86%	0.857	83%	0.83	S	S	*	*			trans	-59.5	136.3	-178.4	-80.7	173.7	172.5	174.1	0	111.7
83	V	27.5	Very low	28.6	Very low	128 Å²	128	147.8 Å²	147.8	78%	0.776	82%	0.821	S	S	*	*			trans	-76	128.7	166	173.6	0	0	0	0	109.3
84	L	29	Very low	28.3	Very low	178 Å²	178	148.6 Å²	148.6	93%	0.932	81%	0.813	S	S	*	*			trans	-116.1	130.6	151.9	-88.2	164.4	0	0	0	108.5
85	R	25.5	Very low	28.1	Very low	244 Å²	244	145.4 Å²	145.4	92%	0.921	81%	0.808	S	S	*	*			trans	-94.2	140.4	-175.6	-116.9	179.6	178.3	167.8	-1.5	109.9
86	G	25.6	Very low	28.2	Very low	83 Å²	83	147.7 Å²	147.7	86%	0.856	81%	0.808	S	S	*	*			trans	113.9	124.3	139.6	0	0	0	0	0	118
87	G	25.8	Very low	28.4	Very low	86 Å²	86	145.9 Å²	145.9	89%	0.887	81%	0.807	S	S	*	*			trans	157.6	128.4	163.4	0	0	0	0	0	113.2
88	A	27.8	Very low	28.3	Very low	98 Å²	98	147.5 Å²	147.5	81%	0.81	81%	0.805	S	S	*	*			trans	-97.8	146.3	-158.8	0	0	0	0	0	116.4
89	K	27.1	Very low	28	Very low	193 Å²	193	145.5 Å²	145.5	84%	0.839	81%	0.807	S	S	*	*			trans	36.8	129.1	150.8	-66.1	-176.1	178.8	179.9	0	122.1
90	S	24.9	Very low	28.1	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	81%	0.809	S	S	*	*				-143.3	132.4	124.6	173.5	0	0	0	0	109.3
91	I	30.1	Very low	27.9	Very low	145 Å²	145	145.6 Å²	145.6	74%	0.744	81%	0.811	S	S	*	*			trans	-86.5	112.7	-178.6	-68.5	166.9	0	0	0	107.2
92	Y	25.3	Very low	28	Very low	218 Å²	218	146.1 Å²	146.1	86%	0.855	81%	0.814	S	S	*	*			trans	-122.4	116.5	161	-161.4	-95.7	0	0	0	107.3	D94	Y92-D94 PolarHBondContact O-N 2.73Å
93	A	26.1	Very low	28	Very low	87 Å²	87	141 Å²	141	72%	0.719	81%	0.808	S	S	*	*			trans	-77.5	109	-179.8	0	0	0	0	0	109.3
94	D	28.8	Very low	28.2	Very low	106 Å²	106	138.4 Å²	138.4	57%	0.567	81%	0.807	S	S	*	*			trans	-73.8	126.4	172.4	176.7	2.7	0	0	0	110.6	Y92 Q96	Y92-D94 PolarHBondContact O-N 2.73Å; D94-Q96 PolarHBondContact O-N 3.41Å; D94-Q96 PolarHBondContact OD1-N 2.85Å
95	P	28.3	Very low	28.6	Very low	114 Å²	114	133.6 Å²	133.6	74%	0.74	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	1.7	178	-15	29.4	0	0	0	116	K97	P95-K97 PolarHBondContact O-N 3.19Å
96	Q	32.1	Very low	29.3	Very low	168 Å²	168	127.7 Å²	127.7	79%	0.785	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	14.4	-173.9	-73.2	-170.2	-8.7	0	0	117.2	D94 H98	D94-Q96 PolarHBondContact O-N 3.41Å; D94-Q96 PolarHBondContact OD1-N 2.85Å; Q96-H98 PolarHBondContact O-N 3.1Å
97	K	32.8	Very low	29.7	Very low	198 Å²	198	131.9 Å²	131.9	86%	0.861	77%	0.773	S	S	*	*			trans	-100.3	74.1	171.7	-84.9	-176.1	177.6	174.3	0	113	P95	P95-K97 PolarHBondContact O-N 3.19Å
98	H	28.3	Very low	30	Very low	167 Å²	167	136.9 Å²	136.9	77%	0.773	77%	0.765	S	S	*	*			trans	-93.5	139	148.1	-73.9	-68.2	0	0	0	109.3	Q96 G100	Q96-H98 PolarHBondContact O-N 3.1Å; H98-G100 PolarHBondContact O-N 2.83Å
99	P	25.3	Very low	30.2	Very low	133 Å²	133	138 Å²	138	86%	0.864	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	116.1	178.6	29.2	-29.5	0	0	0	109
100	G	30.3	Very low	30.4	Very low	76 Å²	76	135.4 Å²	135.4	78%	0.784	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	150.8	-0.1	167.2	0	0	0	0	0	119.3	H98	H98-G100 PolarHBondContact O-N 2.83Å
101	I	26.9	Very low	30.5	Very low	165 Å²	165	135.2 Å²	135.2	85%	0.846	75%	0.753	S	S	*	*			trans	-129	117.1	-179.4	-55.6	177.4	0	0	0	109.5
102	I	31.7	Very low	30.6	Very low	167 Å²	167	134 Å²	134	86%	0.856	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-81	117.2	171.3	-60.6	174.1	0	0	0	106.9	G104	I102-G104 PolarHBondContact O-N 2.95Å
103	A	27.8	Very low	30.9	Very low	89 Å²	89	130.8 Å²	130.8	74%	0.736	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-62.1	130.1	169.7	0	0	0	0	0	109.6	D105	A103-D105 PolarHBondContact O-N 3.09Å
104	G	33.1	Very low	31.1	Very low	73 Å²	73	131.4 Å²	131.4	75%	0.753	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-63.2	128.8	177.4	0	0	0	0	0	111.1	I102 P106	I102-G104 PolarHBondContact O-N 2.95Å; G104-P106 WeakPolarHBondContact O-CD 3.41Å
105	D	37.3	Very low	31.1	Very low	78 Å²	78	131.9 Å²	131.9	42%	0.417	76%	0.76	S	S	.	*	P	Polyproline II helix	trans	-75.5	117.8	172.5	174.8	2.5	0	0	0	109.3	A103 H107 R108	A103-D105 PolarHBondContact O-N 3.09Å; D105-H107 PolarHBondContact O-N 3.24Å; D105-H107 VanDerWaalsContact O-N 3.11Å; D105-H107 PolarHBondContact OD1-N 2.91Å; D105-R108 HydrophobicContact CB-CB 4.37Å; D105-R108 PolarHBondContact O-N 3.47Å; D105-R108 VanDerWaalsContact O-N 3.09Å; D105-R108 IonicContact OD2-NE 3.41Å
106	P	39.1	Very low	31.4	Very low	120 Å²	120	132.3 Å²	132.3	78%	0.779	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-7.9	-179.6	26	-32.7	0	0	0	114.1	G104	G104-P106 WeakPolarHBondContact O-CD 3.41Å
107	H	34.4	Very low	31.1	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.787	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	9.1	173.8	-64	-59.4	0	0	0	113.9	D105	D105-H107 PolarHBondContact O-N 3.24Å; D105-H107 VanDerWaalsContact O-N 3.11Å; D105-H107 PolarHBondContact OD1-N 2.91Å
108	R	32	Very low	30.8	Very low	191 Å²	191	131.5 Å²	131.5	72%	0.721	77%	0.767	S	S	*	*	S	Bend	trans	-128.7	114.7	171.6	-73.1	-176.3	176.6	-149.4	-1.3	110.5	D105 I110	D105-R108 HydrophobicContact CB-CB 4.37Å; D105-R108 PolarHBondContact O-N 3.47Å; D105-R108 VanDerWaalsContact O-N 3.09Å; D105-R108 IonicContact OD2-NE 3.41Å; R108-I110 PolarHBondContact O-N 3.26Å
109	P	31.6	Very low	30.7	Very low	121 Å²	121	129.6 Å²	129.6	79%	0.786	77%	0.767	S	S	*	*			trans	-61.7	140.1	171.6	24.6	-30.4	0	0	0	110.2
110	I	32.7	Very low	30.8	Very low	140 Å²	140	131.3 Å²	131.3	72%	0.718	77%	0.769	S	S	*	*			trans	-51.1	126.2	166.2	-60.1	170.4	0	0	0	106.7	R108 V112	R108-I110 PolarHBondContact O-N 3.26Å; I110-V112 PolarHBondContact O-N 2.84Å
111	P	27	Very low	30.6	Very low	113 Å²	113	136 Å²	136	73%	0.734	77%	0.771	S	S	*	*			trans	-67.7	100.1	-178.9	26.2	-30.8	0	0	0	108.3	L113	P111-L113 PolarHBondContact O-N 3.03Å
112	V	32.5	Very low	30.5	Very low	119 Å²	119	135.2 Å²	135.2	72%	0.721	77%	0.768	S	S	*	*			trans	-55	130.6	147.4	179.6	0	0	0	0	105	I110 S114	I110-V112 PolarHBondContact O-N 2.84Å; V112-S114 PolarHBondContact O-N 3.48Å; V112-S114 PolarHBondContact O-OG 2.68Å
113	L	30.1	Very low	30.2	Very low	152 Å²	152	138.7 Å²	138.7	80%	0.796	77%	0.771	S	S	*	*			trans	-65	77.9	175.6	-74.3	162.1	0	0	0	109.3	P111	P111-L113 PolarHBondContact O-N 3.03Å
114	S	32	Very low	30	Very low	100 Å²	100	142.8 Å²	142.8	70%	0.699	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-99.9	118.8	171	46.1	0	0	0	0	108.5	V112	V112-S114 PolarHBondContact O-N 3.48Å; V112-S114 PolarHBondContact O-OG 2.68Å
115	S	27.4	Very low	29.7	Very low	116 Å²	116	144.8 Å²	144.8	81%	0.811	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-66.7	152.4	162.4	-64.8	0	0	0	0	110.3
116	P	34.3	Very low	29.3	Very low	123 Å²	123	146.6 Å²	146.6	80%	0.799	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-79.2	152.6	-157.8	30.5	-33.6	0	0	0	114.7
117	N	26.1	Very low	28.9	Very low	159 Å²	159	147 Å²	147	85%	0.85	80%	0.796	S	S	*	*			trans	-31.1	134.5	175.2	-69.4	-19.9	0	0	0	116.4
118	H	27.3	Very low	28.5	Very low	190 Å²	190	149 Å²	149	88%	0.88	80%	0.802	S	S	*	*			trans	-113.8	134.5	146.9	-89.7	-66.7	0	0	0	109.9
119	T	26.7	Very low	28.2	Very low	127 Å²	127	151.7 Å²	151.7	78%	0.779	81%	0.812	S	S	*	*			trans	-61.4	145.2	-177.8	39.8	0	0	0	0	113.2
120	N	26.4	Very low	27.9	Very low	168 Å²	168	149.8 Å²	149.8	90%	0.898	81%	0.807	S	S	*	*			trans	-64.9	129.5	163.7	-74.3	-33.3	0	0	0	109.6
121	E	26	Very low	27.5	Very low	175 Å²	175	150.1 Å²	150.1	82%	0.818	82%	0.816	S	S	*	*			trans	-127.1	131.4	148.6	-76.6	-163.1	160.1	0	0	108.3
122	D	25.4	Very low	27.5	Very low	148 Å²	148	154.8 Å²	154.8	79%	0.791	82%	0.824	S	S	*	*			trans	-54	158.7	165.6	-78.4	-44	0	0	0	111.2
123	W	24.8	Very low	27.1	Very low	240 Å²	240	153.8 Å²	153.8	91%	0.909	83%	0.828	S	S	*	*				-178.2	133.1	129.6	-83.5	115.9	0	0	0	110.8
124	E	24.7	Very low	26.9	Very low	176 Å²	176	156 Å²	156	82%	0.822	83%	0.832	S	S	*	*			trans	-74.1	155	168.7	-64.8	-179.6	138.5	0	0	112.6
125	S	26.9	Very low	26.6	Very low	114 Å²	114	160.4 Å²	160.4	80%	0.797	84%	0.841	S	S	*	*			trans	93.5	148.2	151.5	-59.6	0	0	0	0	121.3
126	P	28.5	Very low	26.6	Very low	117 Å²	117	160.5 Å²	160.5	76%	0.76	84%	0.842	S	S	*	*			trans	-106.3	174.9	-139.9	41.7	-34.8	0	0	0	116
127	P	30	Very low	26.3	Very low	128 Å²	128	160.4 Å²	160.4	83%	0.831	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-92.5	146.4	-156.6	35.6	-32.4	0	0	0	114.9
128	K	25.7	Very low	26.7	Very low	213 Å²	213	156.1 Å²	156.1	93%	0.926	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-103.5	147.5	163.8	-76.8	-174.7	178.9	177.7	0	111.7
129	R	25.3	Very low	27	Very low	246 Å²	246	155.9 Å²	155.9	93%	0.928	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-81	146.4	-169	-118.1	174.7	175.1	173.4	-2.3	114.1
130	A	26.5	Very low	27.3	Very low	81 Å²	81	159.1 Å²	159.1	67%	0.669	84%	0.838	S	S	*	*			trans	66.3	128.9	138.5	0	0	0	0	0	121.6
131	T	24.3	Very low	27.8	Very low	148 Å²	148	155.9 Å²	155.9	91%	0.908	83%	0.829	S	S	*	*				178.3	160.1	98.9	30.3	0	0	0	0	113.2
132	K	26.3	Very low	28.4	Very low	210 Å²	210	156 Å²	156	91%	0.913	83%	0.829	S	S	*	*			trans	-92.1	168.9	-171.7	-91.6	-179.6	173.1	179.1	0	113.3
133	A	24.8	Very low	29.2	Very low	98 Å²	98	156.8 Å²	156.8	81%	0.81	83%	0.832	S	S	*	*			trans	100.9	143.5	159.4	0	0	0	0	0	114
134	K	25.1	Very low	29.9	Very low	200 Å²	200	151 Å²	151	87%	0.87	82%	0.818	S	S	*	*			cis	-165.2	146.7	23	-159.4	174.2	-179.2	179.1	0	108.5
135	E	26.7	Very low	30.5	Very low	192 Å²	192	147 Å²	147	90%	0.897	81%	0.808	S	S	*	*			trans	-70.8	140.3	166.8	-79.8	173.3	140.4	0	0	111.1
136	S	26.8	Very low	31.1	Very low	117 Å²	117	144.7 Å²	144.7	82%	0.818	80%	0.802	S	S	*	*			trans	-138.9	131.8	160.5	66.2	0	0	0	0	110.5
137	S	28.8	Very low	31.7	Very low	121 Å²	121	144.1 Å²	144.1	85%	0.846	80%	0.798	S	S	*	*			trans	-63.2	134.9	-176.6	49.8	0	0	0	0	115.7
138	G	34.2	Very low	32.1	Very low	70 Å²	70	144 Å²	144	72%	0.722	79%	0.785	S	S	*	*			trans	19	118.8	143.6	0	0	0	0	0	121.6
139	F	33.7	Very low	32.8	Very low	185 Å²	185	138 Å²	138	81%	0.811	77%	0.767	S	S	*	*	S	Bend	trans	-138.1	129.3	144.2	-148.7	-104.1	0	0	0	106.1
140	F	33	Very low	33.5	Very low	194 Å²	194	136.4 Å²	136.4	85%	0.851	76%	0.76	S	S	*	*			trans	98	34.7	-174.1	-53.4	-70.8	0	0	0	119.5
141	S	35.8	Very low	34.1	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	75%	0.748	S	S	*	*			trans	-92.2	2.1	166.9	57.7	0	0	0	0	115.4
142	H	38.3	Very low	34.6	Very low	176 Å²	176	132.2 Å²	132.2	82%	0.815	73%	0.727	S	S	*	*	S	Bend	trans	-110.2	56.4	-174.6	-78	-57	0	0	0	114.2
143	L	42.7	Very low	35	Very low	166 Å²	166	129 Å²	129	87%	0.869	72%	0.715	S	S	*	*	S	Bend	trans	-162	46.5	167.5	-110	155.4	0	0	0	114.5
144	L	39.1	Very low	35.7	Very low	117 Å²	117	129.5 Å²	129.5	61%	0.613	71%	0.709	S	S	*	*			trans	-145.7	141.2	165.2	-73.4	175.6	0	0	0	112.5	F148	L144-F148 HydrophobicContact CB-CB 4.41Å; L144-F148 HydrophobicContact CD1-CB 4.32Å
145	P	37.5	Very low	36.2	Very low	94 Å²	94	125.9 Å²	125.9	61%	0.61	70%	0.698	S	S	*	*			trans	-70.7	159.1	176.6	3.3	8.5	0	0	0	112.9	P147 F148	P145-P147 WeakPolarHBondContact O-CD 3.02Å; P145-P147 VanDerWaalsContact O-N 3.08Å; P145-F148 PolarHBondContact O-N 2.87Å
146	G	40.6	Very low	36.6	Very low	65 Å²	65	125.2 Å²	125.2	67%	0.67	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-12.4	-166.2	0	0	0	0	0	121.6
147	P	40.6	Very low	36.8	Very low	104 Å²	104	125.2 Å²	125.2	68%	0.675	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-5.3	172.1	26.5	-23.2	0	0	0	114.2	P145	P145-P147 WeakPolarHBondContact O-CD 3.02Å; P145-P147 VanDerWaalsContact O-N 3.08Å
148	F	38.5	Very low	36.7	Very low	125 Å²	125	122.5 Å²	122.5	55%	0.548	68%	0.679	S	S	.	*	S	Bend	trans	-94.6	-17.2	-178.3	-101.7	-88.5	0	0	0	115.4	L144 P145	L144-F148 HydrophobicContact CB-CB 4.41Å; L144-F148 HydrophobicContact CD1-CB 4.32Å; P145-F148 PolarHBondContact O-N 2.87Å
149	T	39.7	Very low	37.1	Very low	89 Å²	89	131.1 Å²	131.1	55%	0.546	69%	0.689	S	S	.	*	H	α-helix	trans	-74.6	-28.9	178	39.9	0	0	0	0	113	A151 L152 E153	T149-A151 VanDerWaalsContact C-N 3.31Å; T149-A151 PolarHBondContact O-N 2.89Å; T149-L152 PolarHBondContact O-N 2.75Å; T149-E153 PolarHBondContact O-N 3.12Å
150	R	40.3	Very low	36.7	Very low	212 Å²	212	134 Å²	134	80%	0.8	70%	0.695	S	S	*	*	H	α-helix	trans	-73	-17.1	174.6	-96.2	-176.5	-178.5	170.9	1.3	115
151	A	38.6	Very low	37.1	Very low	49 Å²	49	134.6 Å²	134.6	41%	0.405	70%	0.697	S	S	.	*	H	α-helix	trans	-91.9	-15.6	178.3	0	0	0	0	0	113.1	T149 T154	T149-A151 VanDerWaalsContact C-N 3.31Å; T149-A151 PolarHBondContact O-N 2.89Å; A151-T154 PolarHBondContact O-OG1 2.76Å
152	L	35.2	Very low	36.8	Very low	92 Å²	92	133.3 Å²	133.3	48%	0.482	70%	0.7	S	S	.	*	H	α-helix	trans	-94	-27.2	177.4	-93.9	157.1	0	0	0	112.6	T149 T154 L155	T149-L152 PolarHBondContact O-N 2.75Å; L152-T154 PolarHBondContact O-N 3.38Å; L152-L155 PolarHBondContact O-N 3.12Å
153	E	35.5	Very low	36.2	Very low	141 Å²	141	134.2 Å²	134.2	66%	0.659	71%	0.705	S	S	*	*	H	α-helix	trans	-66.9	-23.3	170.4	-75.6	-175.9	159	0	0	113.2	T149	T149-E153 PolarHBondContact O-N 3.12Å
154	T	39.3	Very low	36.1	Very low	110 Å²	110	134.7 Å²	134.7	68%	0.675	71%	0.707	S	S	*	*	H	α-helix	trans	-81.4	-11.9	174.6	39.4	0	0	0	0	114.3	A151 L152	A151-T154 PolarHBondContact O-OG1 2.76Å; L152-T154 PolarHBondContact O-N 3.38Å
155	L	35.5	Very low	35.7	Very low	124 Å²	124	134.8 Å²	134.8	65%	0.649	72%	0.718	S	S	*	*	H	α-helix	trans	-102.6	-17.6	-175.9	-76.4	168.1	0	0	0	114.3	L152	L152-L155 PolarHBondContact O-N 3.12Å
156	F	35	Very low	35.6	Very low	177 Å²	177	133.6 Å²	133.6	78%	0.776	72%	0.723	S	S	*	*	H	α-helix	trans	-130.5	10.2	-174.9	-74.7	-74.7	0	0	0	117
157	V	30.5	Very low	35.5	Very low	117 Å²	117	139.9 Å²	139.9	71%	0.709	73%	0.731	S	S	*	*			trans	-110.1	114	169.9	-178.9	0	0	0	0	110.4
158	G	28.3	Very low	35.9	Very low	64 Å²	64	139 Å²	139	66%	0.66	73%	0.728	S	S	*	*			trans	-58.3	148.1	177.1	0	0	0	0	0	113.8
159	R	41.8	Very low	36.9	Very low	251 Å²	251	133.6 Å²	133.6	95%	0.947	71%	0.707	S	S	*	*			trans	51.3	87.4	150.9	-147.2	178.5	-163.1	172.9	4.4	115.1
160	R	26.1	Very low	37.8	Very low	245 Å²	245	130.4 Å²	130.4	93%	0.925	69%	0.687	S	S	*	*			trans	-116.1	121.8	146.8	-82.2	-173.6	-176.9	177.2	3.1	110.5	G162	R160-G162 PolarHBondContact O-N 3.21Å
161	K	39.9	Very low	38.8	Very low	207 Å²	207	125.3 Å²	125.3	90%	0.9	68%	0.684	S	S	*	*			trans	-18.8	117	154.8	-107.2	168.8	167.5	177.9	0	110.7	E163	K161-E163 PolarHBondContact O-N 3.22Å
162	G	30.1	Very low	40	Very low	75 Å²	75	127.3 Å²	127.3	77%	0.773	69%	0.685	S	S	*	*			trans	-53.5	126.5	171.7	0	0	0	0	0	110.2	R160	R160-G162 PolarHBondContact O-N 3.21Å
163	E	26.4	Very low	41.7	Very low	194 Å²	194	124.6 Å²	124.6	91%	0.907	67%	0.669	S	S	*	*			trans	-61.2	136.6	177.1	-109.6	160.4	136.8	0	0	111.4	K161 S165	K161-E163 PolarHBondContact O-N 3.22Å; E163-S165 PolarHBondContact O-N 3.28Å
164	L	40.3	Very low	43.5	Very low	176 Å²	176	119.8 Å²	119.8	92%	0.921	65%	0.646	S	S	*	*			trans	-65.2	113.1	175.6	-73.5	127.2	0	0	0	110
165	S	29.6	Very low	44.4	Very low	120 Å²	120	116.1 Å²	116.1	84%	0.839	63%	0.63	S	S	*	*			trans	-108.5	111.2	148.2	-177.3	0	0	0	0	106.9	E163 K167	E163-S165 PolarHBondContact O-N 3.28Å; S165-K167 PolarHBondContact O-N 2.91Å
166	G	35.2	Very low	45.3	Very low	69 Å²	69	116 Å²	116	71%	0.711	64%	0.64	S	S	*	*	S	Bend	trans	-66.5	112.8	-170.3	0	0	0	0	0	112.9
167	K	38.2	Very low	46	Very low	196 Å²	196	114.5 Å²	114.5	85%	0.852	63%	0.633	S	S	*	*			trans	-164.5	110.8	131.5	-101	172.1	-171.4	-176.5	0	107.8	S165	S165-K167 PolarHBondContact O-N 2.91Å
168	S	50.5	Low	46.6	Very low	85 Å²	85	111.9 Å²	111.9	59%	0.594	63%	0.629	S	S	*	*			trans	-44.8	143.1	174.1	145.2	0	0	0	0	112.1	E172	S168-E172 WeakPolarHBondContact CB-OE2 3.38Å
169	G	59.1	Low	47.2	Very low	12 Å²	12	117.5 Å²	117.5	12%	0.124	64%	0.642	C	S	.	*	S	Bend	trans	-160.7	-96	173.3	0	0	0	0	0	112.5	M192	G169-M192 WeakPolarHBondContact CA-O 3.48Å
170	D	59.4	Low	47.4	Very low	22 Å²	22	110.7 Å²	110.7	12%	0.118	62%	0.624	C	S	.	*	S	Bend	trans	-105.8	-36.6	-170.5	-47.7	-35.7	0	0	0	113.5	E172 F173 F174 G194 L197 A455 F459	D170-E172 VanDerWaalsContact C-N 3.33Å; D170-E172 PolarHBondContact O-N 2Å; D170-F173 WeakPolarHBondContact O-CB 3.45Å; D170-F173 PolarHBondContact O-N 2.87Å; D170-F174 WeakPolarHBondContact O-CD2 3.25Å; D170-F174 PolarHBondContact O-N 3.01Å; D170-G194 VanDerWaalsContact CG-N 3.28Å; D170-G194 PolarHBondContact OD1-N 2.8Å; D170-G194 WeakPolarHBondContact OD2-CA 3.48Å; D170-G194 PolarHBondContact OD2-N 2.82Å; D170-L197 WeakPolarHBondContact OD2-CD1 3.45Å; D170-A455 HydrophobicContact CB-CB 4.41Å; D170-F459 HydrophobicContact CB-CE2 4.19Å
171	S	59.4	Low	48.8	Very low	106 Å²	106	99.6 Å²	99.6	74%	0.741	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-31.9	-177.4	53.6	0	0	0	0	112.7	G175	S171-G175 PolarHBondContact O-N 3.08Å
172	E	63.8	Low	50.3	Low	91 Å²	91	95.9 Å²	95.9	43%	0.425	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.3	-33.7	174.1	-173.1	164.4	-165.8	0	0	111.5	S168 D170 F174 G175 K177	S168-E172 WeakPolarHBondContact CB-OE2 3.38Å; D170-E172 VanDerWaalsContact C-N 3.33Å; D170-E172 PolarHBondContact O-N 2Å; E172-F174 VanDerWaalsContact C-N 3.32Å; E172-F174 PolarHBondContact O-N 2.77Å; E172-G175 PolarHBondContact O-N 3.3Å; E172-K177 IonicContact OE1-NZ 3.22Å; E172-K177 PolarHBondContact OE1-NZ 3.15Å
173	F	72.6	Confident	53.2	Low	35 Å²	35	93.4 Å²	93.4	15%	0.154	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-39.7	175.9	-178.7	-95.5	0	0	0	111.9	D170 G175 W184 P438 K442 T458 F459	D170-F173 WeakPolarHBondContact O-CB 3.45Å; D170-F173 PolarHBondContact O-N 2.87Å; F173-G175 PolarHBondContact O-N 3.14Å; F173-W184 HydrophobicContact CE2-CE3 4.3Å; F173-W184 HydrophobicContact CE2-CZ3 4.43Å; F173-W184 AromaticContact CZ-CE3 3.94Å; F173-W184 HydrophobicContact CZ-CE3 3.94Å; F173-W184 HydrophobicContact CZ-CZ3 4Å; F173-P438 HydrophobicContact CE1-CG 3.99Å; F173-P438 HydrophobicContact CZ-CG 3.69Å; F173-K442 HydrophobicContact CD1-CD 3.99Å; F173-K442 HydrophobicContact CE1-CB 4.12Å; F173-K442 HydrophobicContact CE1-CD 3.7Å; F173-K442 HydrophobicContact CE1-CG 4.46Å; F173-K442 HydrophobicContact CZ-CD 4.04Å; F173-K442 WeakPolarHBondContact O-CD 3.37Å; F173-K442 WeakPolarHBondContact O-CE 3.45Å; F173-K442 PolarHBondContact O-NZ 3.32Å; F173-T458 HydrophobicContact CE1-CG2 4.46Å; F173-F459 HydrophobicContact CB-CE2 4.5Å; F173-F459 HydrophobicContact CB-CZ 3.76Å; F173-F459 HydrophobicContact CD1-CE1 4.19Å; F173-F459 HydrophobicContact CD1-CE2 4.08Å; F173-F459 AromaticContact CD1-CZ 3.36Å; F173-F459 HydrophobicContact CD1-CZ 3.36Å; F173-F459 HydrophobicContact CD2-CE1 4.37Å; F173-F459 HydrophobicContact CD2-CZ 4.07Å; F173-F459 HydrophobicContact CE1-CE1 4.34Å; F173-F459 AromaticContact CE1-CZ 3.88Å; F173-F459 HydrophobicContact CE1-CZ 3.88Å; F173-F459 HydrophobicContact CG-CE1 4.19Å; F173-F459 HydrophobicContact CG-CE2 4.43Å; F173-F459 AromaticContact CG-CZ 3.47Å; F173-F459 HydrophobicContact CG-CZ 3.47Å; F173-F459 VanDerWaalsContact CG-CZ 3.47Å; F173-F459 HydrophobicContact CZ-CZ 4.44Å
174	F	72.1	Confident	56.3	Low	40 Å²	40	84.4 Å²	84.4	18%	0.175	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.8	175.7	-59	-66.8	0	0	0	113.7	D170 E172 K442 T443 P444 A455 T458 F459	D170-F174 WeakPolarHBondContact O-CD2 3.25Å; D170-F174 PolarHBondContact O-N 3.01Å; E172-F174 VanDerWaalsContact C-N 3.32Å; E172-F174 PolarHBondContact O-N 2.77Å; F174-K442 HydrophobicContact CD1-CB 4.17Å; F174-K442 HydrophobicContact CD1-CG 4.42Å; F174-K442 HydrophobicContact CE1-CB 4.49Å; F174-T443 VanDerWaalsContact CD1-C 3.49Å; F174-T443 VanDerWaalsContact CE1-O 3.27Å; F174-T443 WeakPolarHBondContact CE1-O 3.45Å; F174-P444 HydrophobicContact CD2-CB 4.45Å; F174-P444 HydrophobicContact CE2-CB 4.32Å; F174-A455 HydrophobicContact CE2-CB 3.71Å; F174-A455 HydrophobicContact CZ-CB 4.16Å; F174-T458 HydrophobicContact CE1-CG2 4.41Å; F174-T458 HydrophobicContact CZ-CG2 4.42Å; F174-F459 AromaticContact CE2-CE2 3.76Å; F174-F459 HydrophobicContact CE2-CE2 3.76Å; F174-F459 HydrophobicContact CZ-CD2 4.37Å; F174-F459 AromaticContact CZ-CE2 3.71Å; F174-F459 HydrophobicContact CZ-CE2 3.71Å
175	G	58.9	Low	58.7	Low	32 Å²	32	79.7 Å²	79.7	33%	0.33	48%	0.479	S	S	.	.	S	Bend	trans	-79.7	163	178.1	0	0	0	0	0	113.6	S171 E172 F173	S171-G175 PolarHBondContact O-N 3.08Å; E172-G175 PolarHBondContact O-N 3.3Å; F173-G175 PolarHBondContact O-N 3.14Å
176	S	54.7	Low	61.7	Low	123 Å²	123	75.6 Å²	75.6	86%	0.86	45%	0.448	S	S	*	.			trans	-86.3	104.5	175	56.9	0	0	0	0	110.8
177	K	48.2	Very low	64.3	Low	145 Å²	145	77.9 Å²	77.9	63%	0.63	44%	0.44	S	S	*	.			trans	-136.3	132	165.3	-83.4	-173.9	176.8	174	0	111.6	E172 G181	E172-K177 IonicContact OE1-NZ 3.22Å; E172-K177 PolarHBondContact OE1-NZ 3.15Å; K177-G181 WeakPolarHBondContact O-CA 3.26Å
178	G	43.4	Very low	66.8	Low	61 Å²	61	69.3 Å²	69.3	63%	0.629	40%	0.403	S	S	*	.	S	Bend	trans	93.6	147.6	154.5	0	0	0	0	0	118	L180 G181	G178-L180 PolarHBondContact O-N 2.62Å; G178-G181 PolarHBondContact O-N 2.93Å
179	I	42.5	Very low	68.7	Low	182 Å²	182	66.6 Å²	66.6	93%	0.933	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-10.4	-171.9	-68.4	166.7	0	0	0	114.3
180	L	45.8	Very low	70.3	Confident	109 Å²	109	66.5 Å²	66.5	57%	0.571	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.3	9.5	170.1	-117.8	134	0	0	0	114.1	G178 Y484	G178-L180 PolarHBondContact O-N 2.62Å; L180-Y484 WeakPolarHBondContact O-CD2 3.31Å; L180-Y484 WeakPolarHBondContact O-CE2 3.43Å
181	G	54.7	Low	71.7	Confident	11 Å²	11	69.1 Å²	69.1	11%	0.113	40%	0.402	C	S	.	.			trans	32	95.1	-175.4	0	0	0	0	0	115.5	K177 G178 V183 Y484	K177-G181 WeakPolarHBondContact O-CA 3.26Å; G178-G181 PolarHBondContact O-N 2.93Å; G181-V183 PolarHBondContact O-N 3.41Å; G181-Y484 WeakPolarHBondContact O-CD2 3.33Å; G181-Y484 WeakPolarHBondContact O-CE2 3.24Å
182	D	72.1	Confident	73.1	Confident	129 Å²	129	67.9 Å²	67.9	69%	0.69	39%	0.385	S	S	*	.			trans	-35.5	126	-167.4	-52.5	-36.2	0	0	0	115.9
183	V	89.7	Confident	74.2	Confident	24 Å²	24	63.8 Å²	63.8	15%	0.145	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-70.9	161	169.3	-179.9	0	0	0	0	109.5	G181 N185 K473 D480 I483	G181-V183 PolarHBondContact O-N 3.41Å; V183-N185 PolarHBondContact O-N 3.39Å; V183-K473 HydrophobicContact CG1-CD 4.45Å; V183-D480 HydrophobicContact CG2-CB 4.08Å; V183-D480 WeakPolarHBondContact CG2-O 3.45Å; V183-I483 HydrophobicContact CG1-CB 3.67Å; V183-I483 HydrophobicContact CG1-CD1 3.64Å; V183-I483 HydrophobicContact CG1-CG1 4.26Å; V183-I483 HydrophobicContact CG1-CG2 3.5Å; V183-I483 HydrophobicContact CG2-CB 4.41Å
184	W	92.6	Very high	74.9	Confident	5 Å²	5	62.8 Å²	62.8	2%	0.019	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-48.8	129.9	176.2	-166.6	-87.9	0	0	0	112.5	F173 M188 L437 P438 F459 L466 K469 N470 K473	F173-W184 HydrophobicContact CE2-CE3 4.3Å; F173-W184 HydrophobicContact CE2-CZ3 4.43Å; F173-W184 AromaticContact CZ-CE3 3.94Å; F173-W184 HydrophobicContact CZ-CE3 3.94Å; F173-W184 HydrophobicContact CZ-CZ3 4Å; W184-M188 HydrophobicContact CD2-SD 4.01Å; W184-M188 HydrophobicContact CE3-SD 4.16Å; W184-M188 HydrophobicContact CH2-CE 4.24Å; W184-M188 HydrophobicContact CH2-SD 3.71Å; W184-M188 HydrophobicContact CZ2-CB 4.42Å; W184-M188 HydrophobicContact CZ2-CE 4.36Å; W184-M188 HydrophobicContact CZ2-CG 4.48Å; W184-M188 HydrophobicContact CZ2-SD 3.5Å; W184-M188 WeakPolarHBondContact CZ2-SD 3.42Å; W184-M188 HydrophobicContact CZ3-SD 4.02Å; W184-L437 HydrophobicContact CB-CD1 4.5Å; W184-L437 HydrophobicContact CB-CD2 4.14Å; W184-L437 HydrophobicContact CD2-CD2 4.49Å; W184-L437 HydrophobicContact CG-CD2 4.02Å; W184-P438 HydrophobicContact CE3-CG 4Å; W184-P438 HydrophobicContact CZ3-CG 4.4Å; W184-F459 AromaticContact CH2-CD1 3.67Å; W184-F459 HydrophobicContact CH2-CD1 3.67Å; W184-F459 AromaticContact CH2-CE1 3.86Å; W184-F459 HydrophobicContact CH2-CE1 3.86Å; W184-F459 HydrophobicContact CZ3-CD1 4.05Å; W184-F459 AromaticContact CZ3-CE1 3.83Å; W184-F459 HydrophobicContact CZ3-CE1 3.83Å; W184-L466 HydrophobicContact CZ2-CG 4.16Å; W184-K469 HydrophobicContact CD2-CB 4.01Å; W184-K469 HydrophobicContact CD2-CD 4.19Å; W184-K469 VanDerWaalsContact CE2-CB 3.42Å; W184-K469 HydrophobicContact CE3-CD 4.03Å; W184-K469 HydrophobicContact CG-CB 4.43Å; W184-K469 HydrophobicContact CH2-CB 4.28Å; W184-K469 HydrophobicContact CH2-CD 3.54Å; W184-K469 HydrophobicContact CZ2-CB 3.57Å; W184-K469 HydrophobicContact CZ2-CD 3.73Å; W184-K469 HydrophobicContact CZ2-CG 4.27Å; W184-K469 HydrophobicContact CZ3-CD 3.71Å; W184-N470 PolarHBondContact NE1-OD1 3Å; W184-K473 VanDerWaalsContact O-CE 3.26Å; W184-K473 WeakPolarHBondContact O-CE 3.16Å
185	N	90.9	Very high	75.8	Confident	76 Å²	76	66.8 Å²	66.8	41%	0.406	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-89.9	122.3	174.6	177.5	2.7	0	0	0	109.2	V183 E187 M188 N470	V183-N185 PolarHBondContact O-N 3.39Å; N185-E187 PolarHBondContact O-N 3.07Å; N185-E187 WeakPolarHBondContact OD1-CB 3.24Å; N185-E187 PolarHBondContact OD1-N 3.36Å; N185-M188 HydrophobicContact CB-CG 4.18Å; N185-M188 VanDerWaalsContact O-CG 3.27Å; N185-M188 WeakPolarHBondContact O-CG 3.33Å; N185-M188 PolarHBondContact O-N 2.86Å; N185-N470 PolarHBondContact O-OD1 3.14Å
186	D	91.3	Very high	77.4	Confident	35 Å²	35	71.3 Å²	71.3	19%	0.187	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	1.7	-179	81.9	-55.8	0	0	0	114.2	K225 N470 K473 R474	D186-K225 IonicContact OD2-NZ 2.7Å; D186-K225 PolarHBondContact OD2-NZ 2.85Å; D186-N470 HydrophobicContact CB-CB 4.36Å; D186-N470 WeakPolarHBondContact O-CB 3.3Å; D186-N470 VanDerWaalsContact O-CG 3.3Å; D186-N470 PolarHBondContact O-ND2 2.88Å; D186-K473 HydrophobicContact CB-CB 3.99Å; D186-K473 HydrophobicContact CB-CG 3.81Å; D186-R474 PolarHBondContact O-NH2 3.13Å; D186-R474 IonicContact OD2-CZ 3.47Å; D186-R474 IonicContact OD2-NE 2.92Å; D186-R474 PolarHBondContact OD2-NE 3.11Å; D186-R474 IonicContact OD2-NH2 3.47Å; D186-R474 PolarHBondContact OD2-NH2 2.75Å
187	E	90	Very high	79.1	Confident	116 Å²	116	65.5 Å²	65.5	54%	0.542	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	11.5	169	-54.8	-64.3	179.7	0	0	113.1	N185 S189 K225	N185-E187 PolarHBondContact O-N 3.07Å; N185-E187 WeakPolarHBondContact OD1-CB 3.24Å; N185-E187 PolarHBondContact OD1-N 3.36Å; E187-S189 PolarHBondContact O-N 2.7Å; E187-K225 IonicContact OE1-NZ 2.6Å; E187-K225 PolarHBondContact OE1-NZ 3.17Å; E187-K225 IonicContact OE2-NZ 2.92Å; E187-K225 PolarHBondContact OE2-NZ 3.1Å
188	M	90.1	Very high	81.2	Confident	16 Å²	16	61.6 Å²	61.6	8%	0.079	34%	0.338	C	S	.	.			trans	-58.7	138.6	176.8	-79.5	-167.1	71.4	0	0	111.5	W184 N185 M192 F459 L466 N470	W184-M188 HydrophobicContact CD2-SD 4.01Å; W184-M188 HydrophobicContact CE3-SD 4.16Å; W184-M188 HydrophobicContact CH2-CE 4.24Å; W184-M188 HydrophobicContact CH2-SD 3.71Å; W184-M188 HydrophobicContact CZ2-CB 4.42Å; W184-M188 HydrophobicContact CZ2-CE 4.36Å; W184-M188 HydrophobicContact CZ2-CG 4.48Å; W184-M188 HydrophobicContact CZ2-SD 3.5Å; W184-M188 WeakPolarHBondContact CZ2-SD 3.42Å; W184-M188 HydrophobicContact CZ3-SD 4.02Å; N185-M188 HydrophobicContact CB-CG 4.18Å; N185-M188 VanDerWaalsContact O-CG 3.27Å; N185-M188 WeakPolarHBondContact O-CG 3.33Å; N185-M188 PolarHBondContact O-N 2.86Å; M188-M192 HydrophobicContact CG-CE 4.29Å; M188-M192 HydrophobicContact CG-SD 4.33Å; M188-F459 HydrophobicContact CE-CD1 4.04Å; M188-F459 HydrophobicContact CE-CE1 3.69Å; M188-L466 HydrophobicContact CB-CD1 4.32Å; M188-L466 HydrophobicContact CB-CD2 4.12Å; M188-L466 HydrophobicContact CB-CG 4.16Å; M188-L466 HydrophobicContact CE-CD1 4.03Å; M188-L466 WeakPolarHBondContact O-CD2 3.43Å; M188-N470 PolarHBondContact O-ND2 3.32Å
189	S	92	Very high	83.7	Confident	29 Å²	29	63.9 Å²	63.9	20%	0.203	33%	0.331	C	S	.	.			trans	-136	168.1	177.7	63.5	0	0	0	0	111.7	E187 S191 M192 E407	E187-S189 PolarHBondContact O-N 2.7Å; S189-S191 PolarHBondContact O-N 2.8Å; S189-S191 VanDerWaalsContact O-N 3.09Å; S189-S191 PolarHBondContact OG-OG 3.47Å; S189-M192 WeakPolarHBondContact O-CB 3.23Å; S189-M192 PolarHBondContact O-N 2.86Å; S189-E407 WeakPolarHBondContact CA-OE1 3.39Å; S189-E407 WeakPolarHBondContact CB-OE1 3.39Å
190	S	91	Very high	86.1	Confident	10 Å²	10	57 Å²	57	7%	0.07	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-56.4	-25.7	176.2	74	0	0	0	0	112.7	M192 L193 E407	S190-M192 VanDerWaalsContact C-N 3.26Å; S190-M192 PolarHBondContact O-N 3.38Å; S190-L193 PolarHBondContact O-N 3.47Å; S190-E407 WeakPolarHBondContact CB-OE1 3.32Å; S190-E407 WeakPolarHBondContact CB-OE2 3.47Å; S190-E407 PolarHBondContact N-OE1 3.28Å; S190-E407 PolarHBondContact OG-OE1 3.35Å; S190-E407 PolarHBondContact OG-OE2 2.82Å
191	S	88.9	Confident	88.4	Confident	77 Å²	77	52 Å²	52	54%	0.538	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-68.5	-23.8	177.7	74.6	0	0	0	0	113.6	S189	S189-S191 PolarHBondContact O-N 2.8Å; S189-S191 VanDerWaalsContact O-N 3.09Å; S189-S191 PolarHBondContact OG-OG 3.47Å
192	M	89	Confident	90.2	Very high	79 Å²	79	55.5 Å²	55.5	39%	0.389	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-90.7	-6.3	-179.2	-59.1	174.8	68.2	0	0	112.8	G169 M188 S189 S190	G169-M192 WeakPolarHBondContact CA-O 3.48Å; M188-M192 HydrophobicContact CG-CE 4.29Å; M188-M192 HydrophobicContact CG-SD 4.33Å; S189-M192 WeakPolarHBondContact O-CB 3.23Å; S189-M192 PolarHBondContact O-N 2.86Å; S190-M192 VanDerWaalsContact C-N 3.26Å; S190-M192 PolarHBondContact O-N 3.38Å
193	L	88.2	Confident	91.3	Very high	6 Å²	6	54.3 Å²	54.3	3%	0.031	28%	0.278	C	S	.	.	S	Bend	trans	-77.5	151.6	176.8	-65.9	176	0	0	0	111.5	S190 L197 K198 V201 F459 L466	S190-L193 PolarHBondContact O-N 3.47Å; L193-L197 HydrophobicContact CB-CB 4.3Å; L193-L197 HydrophobicContact CD1-CB 4.33Å; L193-K198 HydrophobicContact CB-CB 4.19Å; L193-V201 HydrophobicContact CD1-CB 4.47Å; L193-V201 HydrophobicContact CD1-CG2 3.69Å; L193-F459 HydrophobicContact CD2-CB 3.94Å; L193-F459 HydrophobicContact CD2-CD1 4.03Å; L193-F459 HydrophobicContact CD2-CG 4.01Å; L193-L466 HydrophobicContact CD1-CD1 4.19Å; L193-L466 HydrophobicContact CD2-CD1 3.67Å; L193-L466 HydrophobicContact CG-CD1 3.98Å
194	G	86.6	Confident	91.4	Very high	13 Å²	13	56.3 Å²	56.3	13%	0.134	28%	0.284	C	S	.	.			trans	-60.5	151.5	167.6	0	0	0	0	0	111.8	D170 R196 L197 K198	D170-G194 VanDerWaalsContact CG-N 3.28Å; D170-G194 PolarHBondContact OD1-N 2.8Å; D170-G194 WeakPolarHBondContact OD2-CA 3.48Å; D170-G194 PolarHBondContact OD2-N 2.82Å; G194-R196 PolarHBondContact O-N 3.11Å; G194-L197 PolarHBondContact O-N 2.76Å; G194-K198 WeakPolarHBondContact O-CB 3.32Å; G194-K198 PolarHBondContact O-N 3.3Å
195	N	90.3	Very high	91.4	Very high	124 Å²	124	57.5 Å²	57.5	66%	0.663	29%	0.289	S	S	*	.	H	α-helix	trans	-50.2	-38.2	-173	-69.7	-23.5	0	0	0	114.1	K199	N195-K199 WeakPolarHBondContact O-CG 3.4Å; N195-K199 PolarHBondContact O-N 3.43Å; N195-K199 VanDerWaalsContact O-N 3.15Å
196	R	92.8	Very high	91.4	Very high	128 Å²	128	57.6 Å²	57.6	48%	0.483	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-55.5	178.3	-174.6	-167.8	67.5	104.1	-3.6	111.3	G194 K198 K199 V200 D454	G194-R196 PolarHBondContact O-N 3.11Å; R196-K198 VanDerWaalsContact C-N 3.34Å; R196-K199 PolarHBondContact O-N 3.3Å; R196-V200 WeakPolarHBondContact O-CG2 3.5Å; R196-V200 PolarHBondContact O-N 3.27Å; R196-V200 VanDerWaalsContact O-N 3.15Å; R196-D454 IonicContact CZ-OD1 2.96Å; R196-D454 IonicContact NH1-OD1 3.94Å; R196-D454 PolarHBondContact NH1-OD1 2.94Å; R196-D454 IonicContact NH1-OD2 3.02Å; R196-D454 IonicContact NH2-OD1 2.62Å; R196-D454 PolarHBondContact NH2-OD1 3.32Å
197	L	90.8	Very high	91.3	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.6	-38.9	-178.4	-75	-175.6	0	0	0	111.6	D170 L193 G194 K199 V200 V201 A455 A456 F459	D170-L197 WeakPolarHBondContact OD2-CD1 3.45Å; L193-L197 HydrophobicContact CB-CB 4.3Å; L193-L197 HydrophobicContact CD1-CB 4.33Å; G194-L197 PolarHBondContact O-N 2.76Å; L197-K199 VanDerWaalsContact C-N 3.32Å; L197-K199 PolarHBondContact O-N 2.94Å; L197-V200 WeakPolarHBondContact O-CB 3.38Å; L197-V200 PolarHBondContact O-N 3.1Å; L197-V201 WeakPolarHBondContact O-CG2 3.33Å; L197-V201 PolarHBondContact O-N 3.07Å; L197-A455 HydrophobicContact CD1-CB 3.98Å; L197-A456 HydrophobicContact CD2-CB 3.75Å; L197-F459 HydrophobicContact CD1-CB 3.89Å; L197-F459 HydrophobicContact CD1-CD2 3.94Å; L197-F459 HydrophobicContact CD1-CG 4.27Å
198	K	93.1	Very high	91.5	Very high	63 Å²	63	58.1 Å²	58.1	27%	0.274	31%	0.306	S	S	.	.	H	α-helix	trans	-53.6	-48.1	173.8	-173.9	173.1	-176	175.6	0	112.1	L193 G194 R196 V200 V201 Q202	L193-K198 HydrophobicContact CB-CB 4.19Å; G194-K198 WeakPolarHBondContact O-CB 3.32Å; G194-K198 PolarHBondContact O-N 3.3Å; R196-K198 VanDerWaalsContact C-N 3.34Å; K198-V200 VanDerWaalsContact C-N 3.35Å; K198-V200 PolarHBondContact O-N 3.23Å; K198-V201 PolarHBondContact O-N 2.95Å; K198-Q202 WeakPolarHBondContact O-CB 3.11Å; K198-Q202 VanDerWaalsContact O-CG 3.24Å; K198-Q202 WeakPolarHBondContact O-CG 3.48Å; K198-Q202 PolarHBondContact O-N 2.05Å
199	K	94.5	Very high	91.7	Very high	109 Å²	109	62 Å²	62	47%	0.474	32%	0.322	S	S	.	.	H	α-helix	trans	-61.2	-41.4	175.1	-75.4	179.9	178.8	-174.5	0	112.2	N195 R196 L197 Q202 N203	N195-K199 WeakPolarHBondContact O-CG 3.4Å; N195-K199 PolarHBondContact O-N 3.43Å; N195-K199 VanDerWaalsContact O-N 3.15Å; R196-K199 PolarHBondContact O-N 3.3Å; L197-K199 VanDerWaalsContact C-N 3.32Å; L197-K199 PolarHBondContact O-N 2.94Å; K199-Q202 PolarHBondContact O-N 3Å; K199-N203 WeakPolarHBondContact O-CB 3.37Å; K199-N203 PolarHBondContact O-N 3.34Å; K199-N203 PolarHBondContact O-ND2 2.93Å; K199-N203 PolarHBondContact O-OD1 3.25Å
200	V	94.4	Very high	91.8	Very high	38 Å²	38	61.3 Å²	61.3	23%	0.23	32%	0.315	C	S	.	.	H	α-helix	trans	-63.2	-46.3	178.3	173	0	0	0	0	111.4	R196 L197 K198 Q202 N203 Y204 A461	R196-V200 WeakPolarHBondContact O-CG2 3.5Å; R196-V200 PolarHBondContact O-N 3.27Å; R196-V200 VanDerWaalsContact O-N 3.15Å; L197-V200 WeakPolarHBondContact O-CB 3.38Å; L197-V200 PolarHBondContact O-N 3.1Å; K198-V200 VanDerWaalsContact C-N 3.35Å; K198-V200 PolarHBondContact O-N 3.23Å; V200-Q202 PolarHBondContact O-N 3.49Å; V200-N203 WeakPolarHBondContact O-CB 3.04Å; V200-N203 PolarHBondContact O-N 3.25Å; V200-Y204 HydrophobicContact CG1-CD2 3.91Å; V200-Y204 HydrophobicContact CG1-CE2 3.9Å; V200-Y204 WeakPolarHBondContact O-CD2 3.28Å; V200-Y204 PolarHBondContact O-N 3.39Å; V200-Y204 VanDerWaalsContact O-N 3.09Å; V200-A461 HydrophobicContact CG1-CB 3.61Å
201	V	92.6	Very high	91.9	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-46.8	176.2	171.3	0	0	0	0	110.5	L193 L197 K198 N203 Y204 Q205 Q410	L193-V201 HydrophobicContact CD1-CB 4.47Å; L193-V201 HydrophobicContact CD1-CG2 3.69Å; L197-V201 WeakPolarHBondContact O-CG2 3.33Å; L197-V201 PolarHBondContact O-N 3.07Å; K198-V201 PolarHBondContact O-N 2.95Å; V201-N203 VanDerWaalsContact C-N 3.31Å; V201-N203 PolarHBondContact O-N 3.08Å; V201-Y204 PolarHBondContact O-N 3.34Å; V201-Y204 VanDerWaalsContact O-N 3.16Å; V201-Q205 HydrophobicContact CG1-CG 4.28Å; V201-Q205 WeakPolarHBondContact O-CG 3.18Å; V201-Q205 PolarHBondContact O-N 2.92Å; V201-Q410 HydrophobicContact CG1-CG 4.38Å
202	Q	93.1	Very high	92	Very high	85 Å²	85	59.2 Å²	59.2	40%	0.397	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-40	176.8	-72.8	173.1	-21.4	0	0	112.7	K198 K199 V200 Q205 A206	K198-Q202 WeakPolarHBondContact O-CB 3.11Å; K198-Q202 VanDerWaalsContact O-CG 3.24Å; K198-Q202 WeakPolarHBondContact O-CG 3.48Å; K198-Q202 PolarHBondContact O-N 2.05Å; K199-Q202 PolarHBondContact O-N 3Å; V200-Q202 PolarHBondContact O-N 3.49Å; Q202-Q205 PolarHBondContact O-N 2.62Å; Q202-A206 WeakPolarHBondContact O-CB 3.01Å; Q202-A206 PolarHBondContact O-N 3Å
203	N	94.7	Very high	91.8	Very high	104 Å²	104	62.6 Å²	62.6	56%	0.556	32%	0.319	S	S	*	.	H	α-helix	trans	-63.6	-41.9	176.1	-70.6	-15.7	0	0	0	111.9	K199 V200 V201 A206 M207	K199-N203 WeakPolarHBondContact O-CB 3.37Å; K199-N203 PolarHBondContact O-N 3.34Å; K199-N203 PolarHBondContact O-ND2 2.93Å; K199-N203 PolarHBondContact O-OD1 3.25Å; V200-N203 WeakPolarHBondContact O-CB 3.04Å; V200-N203 PolarHBondContact O-N 3.25Å; V201-N203 VanDerWaalsContact C-N 3.31Å; V201-N203 PolarHBondContact O-N 3.08Å; N203-A206 PolarHBondContact O-N 3.44Å; N203-M207 WeakPolarHBondContact O-CB 2.97Å; N203-M207 PolarHBondContact O-N 2.76Å
204	Y	93.4	Very high	91.3	Very high	66 Å²	66	64.5 Å²	64.5	26%	0.259	33%	0.331	S	S	.	.	H	α-helix	trans	-76.5	-23.7	176.9	-78	-66.1	0	0	0	113.9	V200 V201 M207 K411 A461 Y462	V200-Y204 HydrophobicContact CG1-CD2 3.91Å; V200-Y204 HydrophobicContact CG1-CE2 3.9Å; V200-Y204 WeakPolarHBondContact O-CD2 3.28Å; V200-Y204 PolarHBondContact O-N 3.39Å; V200-Y204 VanDerWaalsContact O-N 3.09Å; V201-Y204 PolarHBondContact O-N 3.34Å; V201-Y204 VanDerWaalsContact O-N 3.16Å; Y204-M207 HydrophobicContact CD1-CE 4.49Å; Y204-M207 HydrophobicContact CD1-SD 4.14Å; Y204-M207 HydrophobicContact CE1-CE 4.36Å; Y204-M207 HydrophobicContact CE1-SD 4.09Å; Y204-K411 PolarHBondContact O-N 3.28Å; Y204-A461 WeakPolarHBondContact CD2-O 3.25Å; Y204-Y462 AromaticContact CE1-CD2 3.91Å; Y204-Y462 HydrophobicContact CE1-CD2 3.91Å
205	Q	90.8	Very high	90.1	Very high	30 Å²	30	68.7 Å²	68.7	14%	0.14	36%	0.358	C	S	.	.	H	α-helix	trans	-69	-38.4	168.2	-74	165.3	-19.5	0	0	111.2	V201 Q202 P408 K411	V201-Q205 HydrophobicContact CG1-CG 4.28Å; V201-Q205 WeakPolarHBondContact O-CG 3.18Å; V201-Q205 PolarHBondContact O-N 2.92Å; Q202-Q205 PolarHBondContact O-N 2.62Å; Q205-P408 PolarHBondContact NE2-O 3.4Å; Q205-K411 VanDerWaalsContact O-CE 3.28Å; Q205-K411 WeakPolarHBondContact O-CE 3.16Å; Q205-K411 PolarHBondContact O-NZ 3.37Å
206	A	91.4	Very high	88.6	Confident	79 Å²	79	65.1 Å²	65.1	65%	0.653	35%	0.351	S	S	*	.	H	α-helix	trans	-74.1	-43.9	176.8	0	0	0	0	0	111.8	Q202 N203 N208	Q202-A206 WeakPolarHBondContact O-CB 3.01Å; Q202-A206 PolarHBondContact O-N 3Å; N203-A206 PolarHBondContact O-N 3.44Å; A206-N208 PolarHBondContact O-N 2.98Å
207	M	90.3	Very high	86.5	Confident	96 Å²	96	64.4 Å²	64.4	47%	0.473	36%	0.363	S	S	.	.			trans	-64.2	128.2	175.6	-168.2	-177.3	-58.6	0	0	109.6	N203 Y204	N203-M207 WeakPolarHBondContact O-CB 2.97Å; N203-M207 PolarHBondContact O-N 2.76Å; Y204-M207 HydrophobicContact CD1-CE 4.49Å; Y204-M207 HydrophobicContact CD1-SD 4.14Å; Y204-M207 HydrophobicContact CE1-CE 4.36Å; Y204-M207 HydrophobicContact CE1-SD 4.09Å
208	N	92.8	Very high	84.9	Confident	66 Å²	66	67.7 Å²	67.7	35%	0.353	40%	0.397	S	S	.	.			trans	-123.3	56.8	-179.8	-164.9	5.6	0	0	0	110.8	A206 Y210 G211 V212 K411	A206-N208 PolarHBondContact O-N 2.98Å; N208-Y210 PolarHBondContact O-N 2.78Å; N208-G211 PolarHBondContact O-N 2.78Å; N208-G211 PolarHBondContact OD1-N 2.77Å; N208-V212 PolarHBondContact ND2-O 2.63Å; N208-V212 PolarHBondContact OD1-N 3.12Å; N208-K411 HydrophobicContact CB-CD 3.91Å
209	K	94.4	Very high	83.3	Confident	98 Å²	98	65.2 Å²	65.2	43%	0.426	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-38.7	-175.4	179.2	179.7	172.5	-168.7	0	112.2	D367	K209-D367 WeakPolarHBondContact CE-OD1 3.44Å; K209-D367 IonicContact NZ-OD1 2.94Å; K209-D367 PolarHBondContact NZ-OD1 3.47Å; K209-D367 IonicContact NZ-OD2 3.21Å; K209-D367 PolarHBondContact NZ-OD2 2.87Å
210	Y	94.2	Very high	81.6	Confident	13 Å²	13	61.9 Å²	61.9	5%	0.051	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	6.5	-173	-57.7	-76.9	0	0	0	114.1	N208 V212 P352 F355 D367 W395 Y462	N208-Y210 PolarHBondContact O-N 2.78Å; Y210-V212 VanDerWaalsContact C-N 3.33Å; Y210-V212 PolarHBondContact O-N 2.64Å; Y210-P352 HydrophobicContact CD1-CB 4.33Å; Y210-P352 HydrophobicContact CE1-CB 3.47Å; Y210-P352 VanDerWaalsContact CE1-CB 3.47Å; Y210-F355 WeakPolarHBondContact O-CB 3.4Å; Y210-F355 PolarHBondContact O-N 3.04Å; Y210-D367 PolarHBondContact OH-OD2 3.34Å; Y210-W395 HydrophobicContact CD1-CZ2 4.22Å; Y210-W395 HydrophobicContact CD2-CH2 4.02Å; Y210-W395 HydrophobicContact CD2-CZ2 4.29Å; Y210-W395 AromaticContact CG-CH2 3.88Å; Y210-W395 HydrophobicContact CG-CH2 3.88Å; Y210-W395 AromaticContact CG-CZ2 3.75Å; Y210-W395 HydrophobicContact CG-CZ2 3.75Å; Y210-Y462 VanDerWaalsContact CE2-OH 3.3Å; Y210-Y462 WeakPolarHBondContact CE2-OH 3.36Å; Y210-Y462 VanDerWaalsContact CZ-OH 3.25Å; Y210-Y462 PolarHBondContact OH-OH 2.98Å
211	G	93.3	Very high	79.9	Confident	40 Å²	40	61.4 Å²	61.4	41%	0.412	38%	0.376	S	S	.	.			trans	66.5	32.3	177.7	0	0	0	0	0	114.1	N208 K213	N208-G211 PolarHBondContact O-N 2.78Å; N208-G211 PolarHBondContact OD1-N 2.77Å; G211-K213 PolarHBondContact O-N 2.82Å
212	V	92.2	Very high	78.1	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.024	42%	0.415	C	S	.	.			trans	-60.1	127.6	177.2	-178.7	0	0	0	0	109.7	N208 Y210 F355 W395 W398 K411	N208-V212 PolarHBondContact ND2-O 2.63Å; N208-V212 PolarHBondContact OD1-N 3.12Å; Y210-V212 VanDerWaalsContact C-N 3.33Å; Y210-V212 PolarHBondContact O-N 2.64Å; V212-F355 HydrophobicContact CB-CD1 4.48Å; V212-F355 HydrophobicContact CB-CG 4.3Å; V212-F355 HydrophobicContact CG1-CD1 4.37Å; V212-F355 HydrophobicContact CG1-CD2 4.29Å; V212-F355 HydrophobicContact CG1-CE1 4.3Å; V212-F355 HydrophobicContact CG1-CE2 4.23Å; V212-F355 HydrophobicContact CG1-CG 4.37Å; V212-F355 HydrophobicContact CG1-CZ 4.23Å; V212-F355 HydrophobicContact CG2-CB 4.13Å; V212-F355 HydrophobicContact CG2-CD2 4.17Å; V212-F355 HydrophobicContact CG2-CG 4.17Å; V212-W395 HydrophobicContact CG2-CE3 4.39Å; V212-W395 HydrophobicContact CG2-CH2 3.81Å; V212-W395 HydrophobicContact CG2-CZ3 3.6Å; V212-W398 HydrophobicContact CG1-CE3 4.21Å; V212-W398 HydrophobicContact CG1-CH2 3.42Å; V212-W398 VanDerWaalsContact CG1-CH2 3.42Å; V212-W398 HydrophobicContact CG1-CZ2 3.8Å; V212-W398 HydrophobicContact CG1-CZ3 3.63Å; V212-K411 HydrophobicContact CB-CB 4Å; V212-K411 HydrophobicContact CB-CD 4.36Å; V212-K411 HydrophobicContact CB-CG 4.1Å; V212-K411 HydrophobicContact CG1-CG 4.36Å; V212-K411 HydrophobicContact CG2-CB 3.88Å; V212-K411 HydrophobicContact CG2-CG 4.49Å
213	K	84.8	Confident	76.7	Confident	149 Å²	149	72.3 Å²	72.3	65%	0.648	43%	0.425	S	S	*	.			trans	-105.8	123.1	170.6	-55.4	-175.3	-180	176.5	0	107.8	G211 F355 F356	G211-K213 PolarHBondContact O-N 2.82Å; K213-F355 HydrophobicContact CB-CE1 4.46Å; K213-F355 WeakPolarHBondContact O-CE1 3.29Å; K213-F356 HydrophobicContact CB-CE2 4.02Å; K213-F356 HydrophobicContact CD-CD2 4.34Å; K213-F356 HydrophobicContact CD-CE2 3.96Å; K213-F356 HydrophobicContact CG-CD2 4.46Å; K213-F356 HydrophobicContact CG-CE2 4.03Å
214	V	76.4	Confident	75.6	Confident	46 Å²	46	74.9 Å²	74.9	28%	0.279	44%	0.438	S	S	.	.			trans	-91.9	137.7	178.6	-160.5	0	0	0	0	108.7	G219 W398 Q402	V214-G219 WeakPolarHBondContact CG1-O 3.34Å; V214-W398 HydrophobicContact CG2-CH2 4.35Å; V214-Q402 HydrophobicContact CG1-CG 4.21Å
215	S	62.2	Low	75.2	Confident	101 Å²	101	75.5 Å²	75.5	71%	0.706	44%	0.442	S	S	*	.			trans	-83.7	129.6	175.6	-61.5	0	0	0	0	110.1
216	G	58.7	Low	75.3	Confident	49 Å²	49	75.8 Å²	75.8	51%	0.505	44%	0.444	S	S	.	.	S	Bend	trans	103.4	159.7	174.5	0	0	0	0	0	115.7	G218 G219	G216-G218 PolarHBondContact O-N 3.13Å; G216-G219 PolarHBondContact O-N 3.21Å
217	P	48.7	Very low	75.5	Confident	114 Å²	114	74.6 Å²	74.6	74%	0.74	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-62	129.5	174.8	-14.9	28.3	0	0	0	110.7	G219	P217-G219 PolarHBondContact O-N 2.69Å
218	G	58.2	Low	75.7	Confident	69 Å²	69	70.9 Å²	70.9	71%	0.711	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	76.7	1	177.3	0	0	0	0	0	115.9	G216 T220	G216-G218 PolarHBondContact O-N 3.13Å; G218-T220 VanDerWaalsContact C-N 3.26Å; G218-T220 PolarHBondContact O-N 3.17Å
219	G	58.6	Low	75.8	Confident	10 Å²	10	75.8 Å²	75.8	10%	0.103	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	72.8	18.8	178.9	0	0	0	0	0	114.3	V214 G216 P217	V214-G219 WeakPolarHBondContact CG1-O 3.34Å; G216-G219 PolarHBondContact O-N 3.21Å; P217-G219 PolarHBondContact O-N 2.69Å
220	T	59.6	Low	75.9	Confident	40 Å²	40	74.2 Å²	74.2	25%	0.245	43%	0.425	C	S	.	.			trans	-110.3	133.2	174.6	49.2	0	0	0	0	109.4	G218 N222 A406 P408	G218-T220 VanDerWaalsContact C-N 3.26Å; G218-T220 PolarHBondContact O-N 3.17Å; T220-N222 PolarHBondContact O-N 2.85Å; T220-A406 WeakPolarHBondContact CG2-O 3.48Å; T220-P408 HydrophobicContact CG2-CG 4.4Å
221	S	57	Low	76	Confident	28 Å²	28	73.6 Å²	73.6	20%	0.196	42%	0.422	C	S	.	.			trans	-71.8	126.6	171.2	-176	0	0	0	0	108.9	R223	S221-R223 PolarHBondContact O-N 2.98Å; S221-R223 WeakPolarHBondContact OG-CB 3.5Å; S221-R223 WeakPolarHBondContact OG-CD 3.13Å; S221-R223 WeakPolarHBondContact OG-CG 3.25Å; S221-R223 PolarHBondContact OG-N 3.09Å
222	N	56.5	Low	76.2	Confident	157 Å²	157	72 Å²	72	84%	0.84	40%	0.404	S	S	*	.			trans	-70.7	2.6	166.8	-78	-9	0	0	0	112.1	T220	T220-N222 PolarHBondContact O-N 2.85Å
223	R	62.2	Low	76.4	Confident	159 Å²	159	72.8 Å²	72.8	60%	0.6	41%	0.41	S	S	*	.	S	Bend	trans	-74.6	143.5	-177.6	-63.3	174.9	174.9	168.2	-3.6	110.9	S221 D403	S221-R223 PolarHBondContact O-N 2.98Å; S221-R223 WeakPolarHBondContact OG-CB 3.5Å; S221-R223 WeakPolarHBondContact OG-CD 3.13Å; S221-R223 WeakPolarHBondContact OG-CG 3.25Å; S221-R223 PolarHBondContact OG-N 3.09Å; R223-D403 IonicContact NH1-OD2 3.46Å; R223-D403 PolarHBondContact NH1-OD2 2.82Å
224	L	73.1	Confident	76.9	Confident	158 Å²	158	67 Å²	67	83%	0.827	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-59	138.2	171.3	-75.5	151.1	0	0	0	110.4	L226	L224-L226 PolarHBondContact O-N 3.47Å
225	K	84.8	Confident	77.9	Confident	79 Å²	79	64.9 Å²	64.9	34%	0.343	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-60.3	121.2	172.9	-178.9	-178.8	176.7	179.9	0	109.1	D186 E187	D186-K225 IonicContact OD2-NZ 2.7Å; D186-K225 PolarHBondContact OD2-NZ 2.85Å; E187-K225 IonicContact OE1-NZ 2.6Å; E187-K225 PolarHBondContact OE1-NZ 3.17Å; E187-K225 IonicContact OE2-NZ 2.92Å; E187-K225 PolarHBondContact OE2-NZ 3.1Å
226	L	92.5	Very high	79.5	Confident	37 Å²	37	63.8 Å²	63.8	19%	0.194	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-71	147.7	-178.9	-62	-178.9	0	0	0	111.9	L224 E230 L231 Q234 N404 R474	L224-L226 PolarHBondContact O-N 3.47Å; L226-E230 HydrophobicContact CB-CB 4.05Å; L226-E230 HydrophobicContact CD1-CB 4.49Å; L226-E230 HydrophobicContact CD2-CB 4.2Å; L226-E230 HydrophobicContact CG-CB 4.48Å; L226-L231 HydrophobicContact CB-CB 4.28Å; L226-Q234 HydrophobicContact CD1-CB 4.19Å; L226-Q234 HydrophobicContact CD1-CG 4.49Å; L226-N404 WeakPolarHBondContact CB-OD1 3.31Å; L226-N404 WeakPolarHBondContact CG-OD1 3.14Å; L226-N404 PolarHBondContact N-OD1 3.05Å; L226-R474 WeakPolarHBondContact O-CD 3.49Å
227	S	94.9	Very high	81.3	Confident	54 Å²	54	67.1 Å²	67.1	38%	0.378	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-64.7	164.7	165.6	72.2	0	0	0	0	111.3	R229 E230 L231	S227-R229 VanDerWaalsContact C-N 3.26Å; S227-R229 PolarHBondContact O-N 3.27Å; S227-E230 WeakPolarHBondContact CA-OE2 3.4Å; S227-E230 WeakPolarHBondContact CB-OE2 3.49Å; S227-E230 PolarHBondContact N-OE2 3.31Å; S227-E230 PolarHBondContact O-N 3.12Å; S227-E230 VanDerWaalsContact OG-CD 3.29Å; S227-E230 WeakPolarHBondContact OG-CG 3.3Å; S227-E230 PolarHBondContact OG-N 3.3Å; S227-E230 PolarHBondContact OG-OE2 3.28Å; S227-L231 VanDerWaalsContact O-CB 3.26Å; S227-L231 WeakPolarHBondContact O-CB 3.36Å; S227-L231 PolarHBondContact O-N 2.95Å
228	G	95.4	Very high	83.5	Confident	17 Å²	17	66.1 Å²	66.1	18%	0.175	34%	0.341	C	S	.	.	H	α-helix	trans	-57.3	-38.1	178.9	0	0	0	0	0	113.6	L232 R474	G228-L232 WeakPolarHBondContact O-CB 2.83Å; G228-L232 WeakPolarHBondContact O-CD1 3.23Å; G228-L232 VanDerWaalsContact O-CG 3.24Å; G228-L232 WeakPolarHBondContact O-CG 3.37Å; G228-L232 PolarHBondContact O-N 2.78Å; G228-L232 VanDerWaalsContact O-N 3.08Å; G228-R474 VanDerWaalsContact CA-O 3.27Å; G228-R474 WeakPolarHBondContact CA-O 3.41Å
229	R	95.2	Very high	85.3	Confident	169 Å²	169	63.2 Å²	63.2	64%	0.638	31%	0.31	S	S	*	.	H	α-helix	trans	-73.5	-45.9	179.7	-174.5	176.8	179.7	139.2	2.5	112.3	S227 L231 L232 C233 N498	S227-R229 VanDerWaalsContact C-N 3.26Å; S227-R229 PolarHBondContact O-N 3.27Å; R229-L231 VanDerWaalsContact C-N 3.29Å; R229-L231 PolarHBondContact O-N 3.24Å; R229-L232 WeakPolarHBondContact O-CB 2.96Å; R229-L232 PolarHBondContact O-N 3.44Å; R229-C233 PolarHBondContact O-N 3.4Å; R229-N498 PolarHBondContact NH2-O 3.02Å
230	E	95.5	Very high	87.1	Confident	65 Å²	65	67 Å²	67	30%	0.304	32%	0.324	S	S	.	.	H	α-helix	trans	-61.1	-41.1	176.3	-69.9	162.9	131.5	0	0	111	L226 S227 C233 Q234	L226-E230 HydrophobicContact CB-CB 4.05Å; L226-E230 HydrophobicContact CD1-CB 4.49Å; L226-E230 HydrophobicContact CD2-CB 4.2Å; L226-E230 HydrophobicContact CG-CB 4.48Å; S227-E230 WeakPolarHBondContact CA-OE2 3.4Å; S227-E230 WeakPolarHBondContact CB-OE2 3.49Å; S227-E230 PolarHBondContact N-OE2 3.31Å; S227-E230 PolarHBondContact O-N 3.12Å; S227-E230 VanDerWaalsContact OG-CD 3.29Å; S227-E230 WeakPolarHBondContact OG-CG 3.3Å; S227-E230 PolarHBondContact OG-N 3.3Å; S227-E230 PolarHBondContact OG-OE2 3.28Å; E230-C233 PolarHBondContact O-N 3.27Å; E230-Q234 WeakPolarHBondContact O-CB 3.43Å; E230-Q234 PolarHBondContact O-N 2.93Å
231	L	95.5	Very high	88.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-45	175.3	175.1	61.6	0	0	0	112	L226 S227 R229 C233 Q234 L235 L471 M475	L226-L231 HydrophobicContact CB-CB 4.28Å; S227-L231 VanDerWaalsContact O-CB 3.26Å; S227-L231 WeakPolarHBondContact O-CB 3.36Å; S227-L231 PolarHBondContact O-N 2.95Å; R229-L231 VanDerWaalsContact C-N 3.29Å; R229-L231 PolarHBondContact O-N 3.24Å; L231-C233 VanDerWaalsContact C-N 3.35Å; L231-C233 PolarHBondContact O-N 3.25Å; L231-Q234 PolarHBondContact O-N 3.41Å; L231-L235 HydrophobicContact CD1-CD1 4.4Å; L231-L235 HydrophobicContact CD1-CG 4.39Å; L231-L235 HydrophobicContact CG-CD1 4.34Å; L231-L235 WeakPolarHBondContact O-CG 3.47Å; L231-L235 PolarHBondContact O-N 2.96Å; L231-L471 HydrophobicContact CD1-CD2 4.23Å; L231-L471 HydrophobicContact CD1-CG 4.35Å; L231-L471 HydrophobicContact CD2-CB 4.17Å; L231-L471 HydrophobicContact CD2-CD2 4.39Å; L231-L471 HydrophobicContact CD2-CG 3.73Å; L231-M475 HydrophobicContact CB-CG 4.5Å; L231-M475 HydrophobicContact CD2-CG 3.48Å; L231-M475 VanDerWaalsContact CD2-CG 3.48Å; L231-M475 HydrophobicContact CD2-SD 3.89Å; L231-M475 HydrophobicContact CG-CG 3.92Å; L231-M475 HydrophobicContact CG-SD 3.94Å
232	L	97.5	Very high	90.7	Very high	6 Å²	6	66.4 Å²	66.4	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-43.7	176.1	-80.5	167.9	0	0	0	111.9	G228 R229 L235 K236 M425 M475 P492 M497	G228-L232 WeakPolarHBondContact O-CB 2.83Å; G228-L232 WeakPolarHBondContact O-CD1 3.23Å; G228-L232 VanDerWaalsContact O-CG 3.24Å; G228-L232 WeakPolarHBondContact O-CG 3.37Å; G228-L232 PolarHBondContact O-N 2.78Å; G228-L232 VanDerWaalsContact O-N 3.08Å; R229-L232 WeakPolarHBondContact O-CB 2.96Å; R229-L232 PolarHBondContact O-N 3.44Å; L232-L235 PolarHBondContact O-N 3.21Å; L232-K236 PolarHBondContact O-N 3.17Å; L232-M425 HydrophobicContact CD2-CE 3.45Å; L232-M425 VanDerWaalsContact CD2-CE 3.45Å; L232-M475 HydrophobicContact CD1-CB 4.41Å; L232-M475 HydrophobicContact CD2-CB 4.01Å; L232-M475 HydrophobicContact CD2-CG 4.04Å; L232-M475 HydrophobicContact CD2-SD 3.72Å; L232-M475 HydrophobicContact CG-CB 4.05Å; L232-M475 HydrophobicContact CG-CG 3.93Å; L232-M475 HydrophobicContact CG-SD 4.12Å; L232-P492 HydrophobicContact CD1-CG 3.8Å; L232-P492 HydrophobicContact CD2-CG 4.13Å; L232-M497 HydrophobicContact CB-CE 4.08Å; L232-M497 HydrophobicContact CB-SD 3.69Å; L232-M497 HydrophobicContact CD1-SD 4.24Å; L232-M497 HydrophobicContact CD2-SD 4.12Å; L232-M497 HydrophobicContact CG-SD 4.25Å; L232-M497 WeakPolarHBondContact O-CE 3.4Å
233	C	96.8	Very high	92.7	Very high	21 Å²	21	59 Å²	59	14%	0.142	28%	0.281	C	S	.	.	H	α-helix	trans	-66.7	-41.7	175.5	-77	0	0	0	0	112.4	R229 E230 L231 L235 K236 E237 C499	R229-C233 PolarHBondContact O-N 3.4Å; E230-C233 PolarHBondContact O-N 3.27Å; L231-C233 VanDerWaalsContact C-N 3.35Å; L231-C233 PolarHBondContact O-N 3.25Å; C233-L235 VanDerWaalsContact C-N 3.28Å; C233-L235 PolarHBondContact O-N 3.35Å; C233-K236 PolarHBondContact O-N 2.93Å; C233-K236 VanDerWaalsContact O-N 3.16Å; C233-E237 WeakPolarHBondContact O-CB 3.38Å; C233-E237 WeakPolarHBondContact O-CG 3.48Å; C233-E237 PolarHBondContact O-N 3.44Å; C233-C499 WeakPolarHBondContact CA-SG 3.23Å; C233-C499 HydrophobicContact CB-CB 3.78Å; C233-C499 WeakPolarHBondContact CB-SG 3.04Å; C233-C499 VanDerWaalsContact SG-CA 3.54Å; C233-C499 WeakPolarHBondContact SG-CB 3.44Å; C233-C499 CovalentContact SG-SG 2.05Å; C233-C499 PolarHBondContact SG-SG 3.46Å
234	Q	95.1	Very high	94.4	Very high	28 Å²	28	51.5 Å²	51.5	13%	0.131	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-41.1	174	-177.2	-178.6	82.8	0	0	111.8	L226 E230 L231 K238 N404	L226-Q234 HydrophobicContact CD1-CB 4.19Å; L226-Q234 HydrophobicContact CD1-CG 4.49Å; E230-Q234 WeakPolarHBondContact O-CB 3.43Å; E230-Q234 PolarHBondContact O-N 2.93Å; L231-Q234 PolarHBondContact O-N 3.41Å; Q234-K238 HydrophobicContact CG-CD 4.1Å; Q234-K238 HydrophobicContact CG-CG 4.41Å; Q234-K238 VanDerWaalsContact O-CB 3.29Å; Q234-K238 WeakPolarHBondContact O-CB 3.32Å; Q234-K238 PolarHBondContact O-N 3.31Å; Q234-N404 PolarHBondContact OE1-ND2 3.45Å
235	L	97.3	Very high	95.5	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-46.3	175.6	-71.9	168.2	0	0	0	111.4	L231 L232 C233 E237 V239 L397 R400 I422 M475 F494	L231-L235 HydrophobicContact CD1-CD1 4.4Å; L231-L235 HydrophobicContact CD1-CG 4.39Å; L231-L235 HydrophobicContact CG-CD1 4.34Å; L231-L235 WeakPolarHBondContact O-CG 3.47Å; L231-L235 PolarHBondContact O-N 2.96Å; L232-L235 PolarHBondContact O-N 3.21Å; C233-L235 VanDerWaalsContact C-N 3.28Å; C233-L235 PolarHBondContact O-N 3.35Å; L235-E237 VanDerWaalsContact C-N 3.28Å; L235-E237 PolarHBondContact O-N 2.93Å; L235-V239 HydrophobicContact CD2-CG2 3.82Å; L235-V239 VanDerWaalsContact O-CB 3.26Å; L235-V239 WeakPolarHBondContact O-CB 3.37Å; L235-V239 PolarHBondContact O-N 2.83Å; L235-L397 HydrophobicContact CD2-CD1 3.64Å; L235-R400 HydrophobicContact CD2-CB 3.99Å; L235-R400 HydrophobicContact CD2-CG 3.89Å; L235-I422 HydrophobicContact CD1-CD1 4.04Å; L235-I422 HydrophobicContact CD2-CD1 4.37Å; L235-M475 HydrophobicContact CD1-CE 4.03Å; L235-M475 HydrophobicContact CD1-SD 3.23Å; L235-M475 WeakPolarHBondContact CD1-SD 3.34Å; L235-F494 HydrophobicContact CB-CE1 4.15Å; L235-F494 HydrophobicContact CB-CZ 4.22Å
236	K	96.7	Very high	96	Very high	78 Å²	78	42 Å²	42	34%	0.339	21%	0.209	S	C	.	.	H	α-helix	trans	-58.1	-39.5	177.6	175.3	171.8	172.2	165.4	0	112.6	L232 C233 F494 M497	L232-K236 PolarHBondContact O-N 3.17Å; C233-K236 PolarHBondContact O-N 2.93Å; C233-K236 VanDerWaalsContact O-N 3.16Å; K236-F494 HydrophobicContact CB-CD1 3.74Å; K236-F494 HydrophobicContact CB-CE1 4.11Å; K236-F494 HydrophobicContact CB-CG 4.29Å; K236-F494 HydrophobicContact CD-CB 4.29Å; K236-F494 WeakPolarHBondContact CD-O 3.43Å; K236-F494 WeakPolarHBondContact CE-O 3.5Å; K236-F494 HydrophobicContact CG-CB 4.25Å; K236-F494 HydrophobicContact CG-CD1 4.29Å; K236-F494 HydrophobicContact CG-CG 4.4Å; K236-F494 PolarHBondContact NZ-O 3.16Å; K236-M497 HydrophobicContact CB-CE 3.7Å; K236-M497 HydrophobicContact CD-CB 4.34Å; K236-M497 HydrophobicContact CD-CE 3.81Å; K236-M497 HydrophobicContact CG-CE 4.34Å; K236-M497 PolarHBondContact NZ-O 3.3Å
237	E	95.4	Very high	96.1	Very high	119 Å²	119	45.5 Å²	45.5	56%	0.556	23%	0.228	S	C	*	.	H	α-helix	trans	-86.9	-34.8	-174.5	-69.9	172.7	-176.2	0	0	113.6	C233 L235	C233-E237 WeakPolarHBondContact O-CB 3.38Å; C233-E237 WeakPolarHBondContact O-CG 3.48Å; C233-E237 PolarHBondContact O-N 3.44Å; L235-E237 VanDerWaalsContact C-N 3.28Å; L235-E237 PolarHBondContact O-N 2.93Å
238	K	95.3	Very high	96	Very high	93 Å²	93	45.1 Å²	45.1	40%	0.404	22%	0.22	S	C	.	.	H	α-helix	trans	-108.9	-5.6	-169.5	-56.6	-165.2	178.8	-170.3	0	114.6	Q234	Q234-K238 HydrophobicContact CG-CD 4.1Å; Q234-K238 HydrophobicContact CG-CG 4.41Å; Q234-K238 VanDerWaalsContact O-CB 3.29Å; Q234-K238 WeakPolarHBondContact O-CB 3.32Å; Q234-K238 PolarHBondContact O-N 3.31Å
239	V	96.7	Very high	96	Very high	8 Å²	8	50 Å²	50	5%	0.048	24%	0.238	C	C	.	.			trans	-117.1	111.9	-179.6	-175.3	0	0	0	0	110.2	L235 L393 Q396 R400 I422	L235-V239 HydrophobicContact CD2-CG2 3.82Å; L235-V239 VanDerWaalsContact O-CB 3.26Å; L235-V239 WeakPolarHBondContact O-CB 3.37Å; L235-V239 PolarHBondContact O-N 2.83Å; V239-L393 HydrophobicContact CG1-CD1 3.31Å; V239-Q396 HydrophobicContact CG1-CB 4.43Å; V239-Q396 HydrophobicContact CG2-CB 4.27Å; V239-R400 HydrophobicContact CG2-CG 3.71Å; V239-I422 HydrophobicContact CG1-CG2 4.15Å
240	E	95.7	Very high	96	Very high	89 Å²	89	42.7 Å²	42.7	42%	0.416	21%	0.213	S	C	.	.			trans	-90.3	118.5	-179.4	-66.2	174	170.8	0	0	110.2	T242 R392	E240-T242 HydrophobicContact CB-CG2 4.41Å; E240-T242 PolarHBondContact O-N 3.07Å; E240-R392 IonicContact OE2-CZ 2.82Å; E240-R392 IonicContact OE2-NH1 2.87Å; E240-R392 PolarHBondContact OE2-NH1 3.48Å
241	V	97.1	Very high	96.1	Very high	18 Å²	18	39.6 Å²	39.6	11%	0.109	20%	0.198	C	C	.	.			trans	-92.4	92.7	172.4	-175.1	0	0	0	0	109	T267 L393 I422 L423	V241-T267 HydrophobicContact CG1-CG2 4.39Å; V241-L393 HydrophobicContact CG2-CD1 4.2Å; V241-I422 HydrophobicContact CG2-CG2 3.8Å; V241-L423 HydrophobicContact CG1-CD1 3.54Å
242	T	96.7	Very high	96.1	Very high	38 Å²	38	42.2 Å²	42.2	23%	0.233	22%	0.217	C	C	.	.			trans	-129	162.3	179.9	58.1	0	0	0	0	111.9	E240 H390	E240-T242 HydrophobicContact CB-CG2 4.41Å; E240-T242 PolarHBondContact O-N 3.07Å; T242-H390 WeakPolarHBondContact O-CB 3.24Å; T242-H390 PolarHBondContact O-N 3.21Å; T242-H390 WeakPolarHBondContact OG1-CB 3.48Å
243	T	97.8	Very high	96	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.018	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-125.4	158.5	-179.7	49.1	0	0	0	0	110.9	T245 Q265 L266 Y387 I388 L389	T243-T245 PolarHBondContact O-N 3.02Å; T243-Q265 PolarHBondContact O-NE2 2.74Å; T243-Q265 VanDerWaalsContact O-NE2 3.11Å; T243-Q265 PolarHBondContact O-OE1 2.96Å; T243-Q265 PolarHBondContact OG1-OE1 2.72Å; T243-L266 HydrophobicContact CG2-CB 3.71Å; T243-L266 HydrophobicContact CG2-CD1 4.33Å; T243-L266 PolarHBondContact OG1-N 3.33Å; T243-Y387 HydrophobicContact CG2-CD1 4.31Å; T243-Y387 HydrophobicContact CG2-CG 4.37Å; T243-I388 CarbonylContact C-O 3.6Å; T243-I388 WeakPolarHBondContact CA-O 3.39Å; T243-I388 WeakPolarHBondContact CB-O 3.43Å; T243-L389 HydrophobicContact CG2-CD2 4.13Å
244	L	97.4	Very high	96	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.			trans	-68.6	122.5	175.3	-56	-176.3	0	0	0	110.9	F251 L261 L359 W362 F371 I388	L244-F251 HydrophobicContact CD1-CE1 4.17Å; L244-F251 HydrophobicContact CD1-CE2 3.84Å; L244-F251 HydrophobicContact CD1-CZ 3.59Å; L244-F251 HydrophobicContact CD2-CE2 4.09Å; L244-F251 HydrophobicContact CG-CE2 4.47Å; L244-L261 HydrophobicContact CB-CD1 4.37Å; L244-L261 HydrophobicContact CB-CD2 4.42Å; L244-L359 HydrophobicContact CD2-CD1 4.17Å; L244-L359 HydrophobicContact CD2-CD2 3.75Å; L244-W362 HydrophobicContact CD1-CH2 3.86Å; L244-W362 HydrophobicContact CD1-CZ3 3.67Å; L244-W362 HydrophobicContact CD2-CZ3 4.06Å; L244-W362 HydrophobicContact CG-CZ3 4.35Å; L244-F371 HydrophobicContact CD1-CE1 3.92Å; L244-F371 HydrophobicContact CD1-CZ 4.41Å; L244-I388 HydrophobicContact CB-CB 4.42Å; L244-I388 HydrophobicContact CD1-CB 3.8Å; L244-I388 HydrophobicContact CD1-CD1 4.21Å; L244-I388 HydrophobicContact CD1-CG2 3.66Å; L244-I388 HydrophobicContact CG-CB 4.05Å; L244-I388 HydrophobicContact CG-CG2 4.1Å; L244-I388 PolarHBondContact N-O 2.53Å
245	T	95.9	Very high	96.1	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.031	28%	0.276	C	S	.	.			trans	-112.9	160.5	167.1	47.4	0	0	0	0	110.2	T243 D247 H248	T243-T245 PolarHBondContact O-N 3.02Å; T245-D247 WeakPolarHBondContact CB-OD1 3.45Å; T245-D247 PolarHBondContact O-N 3.24Å; T245-D247 PolarHBondContact OG1-OD1 2.96Å; T245-H248 PolarHBondContact N-ND1 3.25Å; T245-H248 VanDerWaalsContact N-ND1 3.17Å; T245-H248 PolarHBondContact O-N 3.47Å; T245-H248 PolarHBondContact O-ND1 3.22Å; T245-H248 VanDerWaalsContact O-ND1 3.1Å; T245-H248 PolarHBondContact OG1-CE1 2.95Å; T245-H248 PolarHBondContact OG1-ND1 3.36Å
246	S	95.3	Very high	96	Very high	33 Å²	33	50.7 Å²	50.7	23%	0.231	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.8	-172.4	57.2	0	0	0	0	115	F251 S252	S246-F251 CarbonylContact O-C 3.41Å; S246-S252 WeakPolarHBondContact O-CA 3.42Å; S246-S252 WeakPolarHBondContact O-CB 3.31Å; S246-S252 PolarHBondContact O-N 3.48Å
247	D	94.4	Very high	96	Very high	110 Å²	110	47 Å²	47	59%	0.588	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-26.6	177.1	59.4	-48.5	0	0	0	112.9	T245 S252	T245-D247 WeakPolarHBondContact CB-OD1 3.45Å; T245-D247 PolarHBondContact O-N 3.24Å; T245-D247 PolarHBondContact OG1-OD1 2.96Å; D247-S252 WeakPolarHBondContact O-CB 3.01Å; D247-S252 PolarHBondContact O-OG 3.28Å
248	H	94.6	Very high	96	Very high	47 Å²	47	45.2 Å²	45.2	22%	0.218	26%	0.264	C	S	.	.	S	Bend	trans	-62.2	138	177.7	-65.3	106.3	0	0	0	112.3	T245 F251 S252 L359	T245-H248 PolarHBondContact N-ND1 3.25Å; T245-H248 VanDerWaalsContact N-ND1 3.17Å; T245-H248 PolarHBondContact O-N 3.47Å; T245-H248 PolarHBondContact O-ND1 3.22Å; T245-H248 VanDerWaalsContact O-ND1 3.1Å; T245-H248 PolarHBondContact OG1-CE1 2.95Å; T245-H248 PolarHBondContact OG1-ND1 3.36Å; H248-F251 HydrophobicContact CB-CD2 4.12Å; H248-F251 CarbonylContact O-C 3.15Å; H248-F251 VanDerWaalsContact O-CA 3.25Å; H248-F251 WeakPolarHBondContact O-CA 3.5Å; H248-F251 VanDerWaalsContact O-CB 3.25Å; H248-F251 WeakPolarHBondContact O-CB 3.44Å; H248-F251 PolarHBondContact O-N 3.15Å; H248-S252 PolarHBondContact O-N 3.33Å; H248-S252 PolarHBondContact O-OG 2.88Å; H248-L359 HydrophobicContact CB-CD1 3.67Å
249	Q	94.1	Very high	96	Very high	118 Å²	118	47.4 Å²	47.4	55%	0.551	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	140.4	165.9	-73.3	-69.6	-32.6	0	0	110.3	S252 L359	Q249-S252 PolarHBondContact NE2-OG 3.16Å; Q249-L359 WeakPolarHBondContact O-CB 3.27Å
250	P	95.8	Very high	96.1	Very high	17 Å²	17	48 Å²	48	11%	0.11	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	cis	-85.9	-1.7	3.4	36.2	-36.7	0	0	0	113.8	S252 A253 L254 T360 Y363	P250-S252 VanDerWaalsContact C-N 3.29Å; P250-S252 PolarHBondContact O-N 3.24Å; P250-A253 WeakPolarHBondContact O-CB 3.39Å; P250-A253 PolarHBondContact O-N 3.01Å; P250-L254 WeakPolarHBondContact O-CG 3.02Å; P250-T360 HydrophobicContact CB-CG2 4.5Å; P250-Y363 HydrophobicContact CG-CD1 4.13Å; P250-Y363 HydrophobicContact CG-CD2 4.44Å; P250-Y363 HydrophobicContact CG-CG 3.86Å
251	F	96.8	Very high	96.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-59.4	-33	-173.6	-55.2	-78.4	0	0	0	113.9	L244 S246 H248 A253 L254 W256 A257 L261 L359 W362 Y363 F371	L244-F251 HydrophobicContact CD1-CE1 4.17Å; L244-F251 HydrophobicContact CD1-CE2 3.84Å; L244-F251 HydrophobicContact CD1-CZ 3.59Å; L244-F251 HydrophobicContact CD2-CE2 4.09Å; L244-F251 HydrophobicContact CG-CE2 4.47Å; S246-F251 CarbonylContact O-C 3.41Å; H248-F251 HydrophobicContact CB-CD2 4.12Å; H248-F251 CarbonylContact O-C 3.15Å; H248-F251 VanDerWaalsContact O-CA 3.25Å; H248-F251 WeakPolarHBondContact O-CA 3.5Å; H248-F251 VanDerWaalsContact O-CB 3.25Å; H248-F251 WeakPolarHBondContact O-CB 3.44Å; H248-F251 PolarHBondContact O-N 3.15Å; F251-A253 PolarHBondContact O-N 3.46Å; F251-L254 HydrophobicContact CD1-CD1 3.99Å; F251-L254 HydrophobicContact CE1-CD1 4.49Å; F251-L254 PolarHBondContact O-N 3Å; F251-W256 AromaticContact CD1-CH2 3.93Å; F251-W256 HydrophobicContact CD1-CH2 3.93Å; F251-W256 AromaticContact CD1-CZ2 3.83Å; F251-W256 HydrophobicContact CD1-CZ2 3.83Å; F251-W256 HydrophobicContact CE1-CH2 4.03Å; F251-W256 AromaticContact CE1-CZ2 3.94Å; F251-W256 HydrophobicContact CE1-CZ2 3.94Å; F251-A257 HydrophobicContact CB-CB 3.84Å; F251-A257 WeakPolarHBondContact O-CB 3.26Å; F251-L261 HydrophobicContact CB-CD1 4.23Å; F251-L261 HydrophobicContact CD1-CD1 4.18Å; F251-L261 HydrophobicContact CG-CD1 4.25Å; F251-L359 HydrophobicContact CE2-CB 4.34Å; F251-L359 HydrophobicContact CE2-CD1 4.29Å; F251-W362 HydrophobicContact CZ-CZ3 4.42Å; F251-Y363 AromaticContact CE1-CD2 3.68Å; F251-Y363 HydrophobicContact CE1-CD2 3.68Å; F251-Y363 HydrophobicContact CE1-CE2 4.03Å; F251-Y363 AromaticContact CZ-CD2 3.94Å; F251-Y363 HydrophobicContact CZ-CD2 3.94Å; F251-F371 AromaticContact CE1-CD1 3.99Å; F251-F371 HydrophobicContact CE1-CD1 3.99Å; F251-F371 AromaticContact CE1-CE1 3.44Å; F251-F371 HydrophobicContact CE1-CE1 3.44Å; F251-F371 VanDerWaalsContact CE1-CE1 3.44Å; F251-F371 AromaticContact CE1-CZ 3.88Å; F251-F371 HydrophobicContact CE1-CZ 3.88Å; F251-F371 AromaticContact CZ-CE1 3.55Å; F251-F371 HydrophobicContact CZ-CE1 3.55Å; F251-F371 AromaticContact CZ-CZ 3.6Å; F251-F371 HydrophobicContact CZ-CZ 3.6Å
252	S	95.9	Very high	96	Very high	55 Å²	55	43.9 Å²	43.9	39%	0.385	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-64.4	-19.5	174.7	32.8	0	0	0	0	114.3	S246 D247 H248 Q249 P250	S246-S252 WeakPolarHBondContact O-CA 3.42Å; S246-S252 WeakPolarHBondContact O-CB 3.31Å; S246-S252 PolarHBondContact O-N 3.48Å; D247-S252 WeakPolarHBondContact O-CB 3.01Å; D247-S252 PolarHBondContact O-OG 3.28Å; H248-S252 PolarHBondContact O-N 3.33Å; H248-S252 PolarHBondContact O-OG 2.88Å; Q249-S252 PolarHBondContact NE2-OG 3.16Å; P250-S252 VanDerWaalsContact C-N 3.29Å; P250-S252 PolarHBondContact O-N 3.24Å
253	A	96.3	Very high	95.8	Very high	78 Å²	78	47.4 Å²	47.4	65%	0.645	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-93	-7.4	172.8	0	0	0	0	0	113.4	P250 F251	P250-A253 WeakPolarHBondContact O-CB 3.39Å; P250-A253 PolarHBondContact O-N 3.01Å; F251-A253 PolarHBondContact O-N 3.46Å
254	L	96.8	Very high	95.6	Very high	39 Å²	39	52.3 Å²	52.3	20%	0.204	31%	0.309	C	S	.	.			trans	-96.5	118.9	-175.2	-61.9	175.2	0	0	0	110.7	P250 F251 W256 A257 P258 Y363	P250-L254 WeakPolarHBondContact O-CG 3.02Å; F251-L254 HydrophobicContact CD1-CD1 3.99Å; F251-L254 HydrophobicContact CE1-CD1 4.49Å; F251-L254 PolarHBondContact O-N 3Å; L254-W256 HydrophobicContact CD1-CZ2 4.04Å; L254-W256 PolarHBondContact O-N 3.06Å; L254-A257 HydrophobicContact CB-CB 4.18Å; L254-A257 WeakPolarHBondContact O-CB 3.49Å; L254-A257 PolarHBondContact O-N 3.12Å; L254-P258 VanDerWaalsContact O-CD 3.23Å; L254-P258 WeakPolarHBondContact O-CD 3.17Å; L254-Y363 HydrophobicContact CD1-CD2 4.25Å; L254-Y363 HydrophobicContact CD1-CE1 4.07Å; L254-Y363 HydrophobicContact CD1-CE2 3.58Å; L254-Y363 VanDerWaalsContact CD1-CZ 3.47Å
255	A	96.4	Very high	95.5	Very high	85 Å²	85	54.4 Å²	54.4	70%	0.702	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.1	-178.1	0	0	0	0	0	114.4	L259	A255-L259 WeakPolarHBondContact O-CD1 3.13Å
256	W	96	Very high	95.5	Very high	32 Å²	32	54.2 Å²	54.2	12%	0.121	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-26.2	180	71	-99.1	0	0	0	113.3	F251 L254 L259 L260 L261 Y363 F371 Y374 Q375	F251-W256 AromaticContact CD1-CH2 3.93Å; F251-W256 HydrophobicContact CD1-CH2 3.93Å; F251-W256 AromaticContact CD1-CZ2 3.83Å; F251-W256 HydrophobicContact CD1-CZ2 3.83Å; F251-W256 HydrophobicContact CE1-CH2 4.03Å; F251-W256 AromaticContact CE1-CZ2 3.94Å; F251-W256 HydrophobicContact CE1-CZ2 3.94Å; L254-W256 HydrophobicContact CD1-CZ2 4.04Å; L254-W256 PolarHBondContact O-N 3.06Å; W256-L259 PolarHBondContact O-N 3.34Å; W256-L260 HydrophobicContact CB-CD1 4.26Å; W256-L260 HydrophobicContact CE3-CB 4.1Å; W256-L260 HydrophobicContact CE3-CD1 4.05Å; W256-L260 WeakPolarHBondContact O-CG 3.32Å; W256-L260 PolarHBondContact O-N 2.82Å; W256-L260 VanDerWaalsContact O-N 3.09Å; W256-L261 HydrophobicContact CH2-CD1 4.48Å; W256-L261 HydrophobicContact CH2-CD2 4.45Å; W256-L261 HydrophobicContact CH2-CG 4.39Å; W256-L261 HydrophobicContact CZ3-CD1 4.45Å; W256-L261 HydrophobicContact CZ3-CD2 4.18Å; W256-L261 HydrophobicContact CZ3-CG 3.95Å; W256-Y363 HydrophobicContact CZ2-CE2 4.09Å; W256-F371 AromaticContact CH2-CD1 3.95Å; W256-F371 HydrophobicContact CH2-CD1 3.95Å; W256-F371 HydrophobicContact CZ2-CD1 4.13Å; W256-Y374 HydrophobicContact CZ3-CD1 4.2Å; W256-Y374 HydrophobicContact CZ3-CE1 4.22Å; W256-Q375 HydrophobicContact CD2-CG 4Å; W256-Q375 HydrophobicContact CE3-CG 3.87Å; W256-Q375 HydrophobicContact CG-CG 4.42Å; W256-Q375 HydrophobicContact CZ3-CG 4.33Å
257	A	96.8	Very high	95.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.4	-53.3	-170.4	0	0	0	0	0	113.4	F251 L254 L259 L260 L261	F251-A257 HydrophobicContact CB-CB 3.84Å; F251-A257 WeakPolarHBondContact O-CB 3.26Å; L254-A257 HydrophobicContact CB-CB 4.18Å; L254-A257 WeakPolarHBondContact O-CB 3.49Å; L254-A257 PolarHBondContact O-N 3.12Å; A257-L259 PolarHBondContact O-N 3.46Å; A257-L259 VanDerWaalsContact O-N 3.15Å; A257-L260 PolarHBondContact O-N 3.18Å; A257-L261 HydrophobicContact CB-CD1 4Å; A257-L261 VanDerWaalsContact O-CB 3.32Å; A257-L261 WeakPolarHBondContact O-CB 3.38Å; A257-L261 PolarHBondContact O-N 2.94Å
258	P	95.3	Very high	95.3	Very high	81 Å²	81	53.9 Å²	53.9	53%	0.526	32%	0.322	S	S	.	.	H	α-helix	trans	-66.3	-17.2	179	27.5	-35.5	0	0	0	113.4	L254	L254-P258 VanDerWaalsContact O-CD 3.23Å; L254-P258 WeakPolarHBondContact O-CD 3.17Å
259	L	95.1	Very high	95.2	Very high	139 Å²	139	54.8 Å²	54.8	73%	0.728	33%	0.328	S	S	*	.	H	α-helix	trans	-85.4	-28.8	178.2	-61.9	172.7	0	0	0	112.8	A255 W256 A257	A255-L259 WeakPolarHBondContact O-CD1 3.13Å; W256-L259 PolarHBondContact O-N 3.34Å; A257-L259 PolarHBondContact O-N 3.46Å; A257-L259 VanDerWaalsContact O-N 3.15Å
260	L	97.2	Very high	95.2	Very high	22 Å²	22	50 Å²	50	12%	0.115	31%	0.306	C	S	.	.	H	α-helix	trans	-118.5	-32.8	-168.8	-58.5	178.4	0	0	0	113.9	W256 A257 Y374 Q375 R378	W256-L260 HydrophobicContact CB-CD1 4.26Å; W256-L260 HydrophobicContact CE3-CB 4.1Å; W256-L260 HydrophobicContact CE3-CD1 4.05Å; W256-L260 WeakPolarHBondContact O-CG 3.32Å; W256-L260 PolarHBondContact O-N 2.82Å; W256-L260 VanDerWaalsContact O-N 3.09Å; A257-L260 PolarHBondContact O-N 3.18Å; L260-Y374 HydrophobicContact CB-CE1 4.25Å; L260-Y374 PolarHBondContact O-OH 3.43Å; L260-Y374 VanDerWaalsContact O-OH 3.07Å; L260-Q375 HydrophobicContact CD1-CB 3.99Å; L260-Q375 HydrophobicContact CD1-CG 3.73Å; L260-R378 HydrophobicContact CB-CB 4.31Å; L260-R378 HydrophobicContact CB-CG 4.42Å; L260-R378 HydrophobicContact CD2-CB 3.91Å; L260-R378 PolarHBondContact O-NE 3.24Å
261	L	97.1	Very high	94.9	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.037	32%	0.319	C	S	.	.	S	Bend	trans	-75.2	142	175.5	-67.2	176.6	0	0	0	110.4	L244 F251 W256 A257 Y374 I388	L244-L261 HydrophobicContact CB-CD1 4.37Å; L244-L261 HydrophobicContact CB-CD2 4.42Å; F251-L261 HydrophobicContact CB-CD1 4.23Å; F251-L261 HydrophobicContact CD1-CD1 4.18Å; F251-L261 HydrophobicContact CG-CD1 4.25Å; W256-L261 HydrophobicContact CH2-CD1 4.48Å; W256-L261 HydrophobicContact CH2-CD2 4.45Å; W256-L261 HydrophobicContact CH2-CG 4.39Å; W256-L261 HydrophobicContact CZ3-CD1 4.45Å; W256-L261 HydrophobicContact CZ3-CD2 4.18Å; W256-L261 HydrophobicContact CZ3-CG 3.95Å; A257-L261 HydrophobicContact CB-CD1 4Å; A257-L261 VanDerWaalsContact O-CB 3.32Å; A257-L261 WeakPolarHBondContact O-CB 3.38Å; A257-L261 PolarHBondContact O-N 2.94Å; L261-Y374 HydrophobicContact CD2-CE1 3.83Å; L261-I388 HydrophobicContact CD2-CD1 4.33Å
262	P	95.4	Very high	94.7	Very high	13 Å²	13	56.1 Å²	56.1	8%	0.084	35%	0.353	C	S	.	.			trans	-57.8	141.5	169.1	-26.6	37.4	0	0	0	111.7	Q264 Y374 F386 Y387	P262-Q264 VanDerWaalsContact C-N 3.33Å; P262-Y374 WeakPolarHBondContact CD-OH 3.17Å; P262-F386 WeakPolarHBondContact CD-O 3.29Å; P262-Y387 HydrophobicContact CB-CD1 3.83Å; P262-Y387 HydrophobicContact CB-CE1 3.41Å; P262-Y387 VanDerWaalsContact CB-CE1 3.41Å; P262-Y387 HydrophobicContact CG-CD1 3.6Å; P262-Y387 HydrophobicContact CG-CE1 3.56Å; P262-Y387 HydrophobicContact CG-CE2 4.5Å; P262-Y387 HydrophobicContact CG-CG 4.11Å
263	P	91.6	Very high	94.8	Very high	111 Å²	111	55.9 Å²	55.9	72%	0.721	34%	0.344	S	S	*	.	S	Bend	trans	-76.4	-21.6	-178.9	30.2	-34.9	0	0	0	113.1
264	Q	93.3	Very high	94.9	Very high	107 Å²	107	59.1 Å²	59.1	50%	0.5	34%	0.343	S	S	.	.	S	Bend	trans	-114.7	161.2	-178.2	-61.7	-169.3	25.7	0	0	111.3	P262 D269	P262-Q264 VanDerWaalsContact C-N 3.33Å; Q264-D269 PolarHBondContact OE1-OD1 3.35Å
265	Q	95.7	Very high	95	Very high	43 Å²	43	58.6 Å²	58.6	20%	0.201	34%	0.343	C	S	.	.			trans	-68.6	143.1	173.8	-66.7	-63	-29.9	0	0	110.2	T243 T267 S268 D269	T243-Q265 PolarHBondContact O-NE2 2.74Å; T243-Q265 VanDerWaalsContact O-NE2 3.11Å; T243-Q265 PolarHBondContact O-OE1 2.96Å; T243-Q265 PolarHBondContact OG1-OE1 2.72Å; Q265-T267 PolarHBondContact O-N 3.37Å; Q265-T267 VanDerWaalsContact O-N 3.16Å; Q265-S268 WeakPolarHBondContact O-CB 3.36Å; Q265-S268 PolarHBondContact O-N 2.91Å; Q265-D269 PolarHBondContact O-N 3.31Å
266	L	95.8	Very high	95.1	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-54.8	-36.4	178.5	177.3	155.8	0	0	0	113	T243 S268 D269 L270 V348 Y387 L423 L427	T243-L266 HydrophobicContact CG2-CB 3.71Å; T243-L266 HydrophobicContact CG2-CD1 4.33Å; T243-L266 PolarHBondContact OG1-N 3.33Å; L266-S268 PolarHBondContact O-N 2.93Å; L266-D269 PolarHBondContact O-N 2.82Å; L266-L270 HydrophobicContact CD1-CD1 4.13Å; L266-L270 HydrophobicContact CD2-CB 4.49Å; L266-L270 HydrophobicContact CD2-CD1 3.75Å; L266-L270 HydrophobicContact CD2-CG 4.33Å; L266-L270 HydrophobicContact CG-CD1 3.68Å; L266-L270 HydrophobicContact CG-CG 4.19Å; L266-L270 WeakPolarHBondContact O-CB 3.31Å; L266-L270 PolarHBondContact O-N 3.32Å; L266-V348 HydrophobicContact CD1-CG1 4.41Å; L266-V348 HydrophobicContact CD1-CG2 3.39Å; L266-Y387 HydrophobicContact CB-CD1 3.72Å; L266-Y387 HydrophobicContact CB-CD2 4.29Å; L266-Y387 HydrophobicContact CB-CE1 3.91Å; L266-Y387 HydrophobicContact CB-CE2 4.46Å; L266-Y387 HydrophobicContact CB-CG 3.94Å; L266-Y387 HydrophobicContact CD1-CD1 4.48Å; L266-Y387 HydrophobicContact CD1-CD2 3.69Å; L266-Y387 HydrophobicContact CD1-CE2 4.28Å; L266-Y387 HydrophobicContact CD1-CG 3.82Å; L266-Y387 HydrophobicContact CG-CD1 4.5Å; L266-Y387 HydrophobicContact CG-CD2 4.19Å; L266-Y387 HydrophobicContact CG-CE2 4.34Å; L266-Y387 HydrophobicContact CG-CG 4.29Å; L266-L423 HydrophobicContact CD2-CD1 3.72Å; L266-L427 HydrophobicContact CD2-CD1 3.76Å; L266-L427 HydrophobicContact CD2-CD2 3.88Å; L266-L427 HydrophobicContact CD2-CG 4.35Å
267	T	93.8	Very high	95.2	Very high	54 Å²	54	53 Å²	53	33%	0.331	30%	0.303	S	S	.	.	H	α-helix	trans	-69.8	-16.8	178.6	48	0	0	0	0	114.1	V241 Q265 L427	V241-T267 HydrophobicContact CG1-CG2 4.39Å; Q265-T267 PolarHBondContact O-N 3.37Å; Q265-T267 VanDerWaalsContact O-N 3.16Å; T267-L427 HydrophobicContact CG2-CD2 3.87Å
268	S	92.5	Very high	95.3	Very high	81 Å²	81	53 Å²	53	57%	0.566	30%	0.304	S	S	*	.	H	α-helix	trans	-86.7	-35.8	171.5	-57	0	0	0	0	111.6	Q265 L266	Q265-S268 WeakPolarHBondContact O-CB 3.36Å; Q265-S268 PolarHBondContact O-N 2.91Å; L266-S268 PolarHBondContact O-N 2.93Å
269	D	92	Very high	95.5	Very high	67 Å²	67	49.3 Å²	49.3	36%	0.358	28%	0.279	S	S	.	.	H	α-helix	trans	-82.2	-25.3	-176.6	-69.6	-24.2	0	0	0	113	Q264 Q265 L266 Y387	Q264-D269 PolarHBondContact OE1-OD1 3.35Å; Q265-D269 PolarHBondContact O-N 3.31Å; L266-D269 PolarHBondContact O-N 2.82Å; D269-Y387 VanDerWaalsContact CB-OH 3.3Å; D269-Y387 WeakPolarHBondContact CB-OH 3.17Å; D269-Y387 PolarHBondContact OD2-OH 2.85Å
270	L	94	Very high	95.7	Very high	17 Å²	17	43.2 Å²	43.2	9%	0.089	25%	0.248	C	C	.	.	S	Bend	trans	-116.7	137.6	-176.2	-55.2	-174.8	0	0	0	112.3	L266 Y273 V321 V346 L427	L266-L270 HydrophobicContact CD1-CD1 4.13Å; L266-L270 HydrophobicContact CD2-CB 4.49Å; L266-L270 HydrophobicContact CD2-CD1 3.75Å; L266-L270 HydrophobicContact CD2-CG 4.33Å; L266-L270 HydrophobicContact CG-CD1 3.68Å; L266-L270 HydrophobicContact CG-CG 4.19Å; L266-L270 WeakPolarHBondContact O-CB 3.31Å; L266-L270 PolarHBondContact O-N 3.32Å; L270-Y273 HydrophobicContact CB-CE2 4.35Å; L270-V321 HydrophobicContact CD1-CG2 4.15Å; L270-V346 HydrophobicContact CD1-CB 4.37Å; L270-V346 HydrophobicContact CD1-CG1 4.1Å; L270-V346 HydrophobicContact CD1-CG2 4.22Å; L270-V346 HydrophobicContact CD2-CG2 3.81Å; L270-L427 HydrophobicContact CB-CD1 4.41Å; L270-L427 HydrophobicContact CB-CD2 4.14Å; L270-L427 HydrophobicContact CD1-CD1 4.43Å; L270-L427 WeakPolarHBondContact O-CD2 3.41Å
271	G	89.4	Confident	95.7	Very high	36 Å²	36	42.9 Å²	42.9	37%	0.371	25%	0.248	S	C	.	.			trans	75.3	-163.4	177	0	0	0	0	0	113.4
272	P	92.9	Very high	95.8	Very high	109 Å²	109	43.5 Å²	43.5	71%	0.708	25%	0.254	S	S	*	.			cis	-67	134.5	-4.1	28.8	-33.9	0	0	0	111.5	L427	P272-L427 CarbonylContact C-O 3.57Å; P272-L427 WeakPolarHBondContact CA-O 3.27Å
273	Y	97.6	Very high	95.9	Very high	50 Å²	50	43 Å²	43	20%	0.196	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	150.3	171.6	-60	-72.2	0	0	0	110	L270 C276 D298 A299 L427 C428 E429	L270-Y273 HydrophobicContact CB-CE2 4.35Å; Y273-C276 VanDerWaalsContact CB-SG 3.51Å; Y273-D298 HydrophobicContact CD1-CB 3.97Å; Y273-D298 HydrophobicContact CG-CB 4.44Å; Y273-A299 HydrophobicContact CD1-CB 3.99Å; Y273-A299 HydrophobicContact CD2-CB 3.8Å; Y273-A299 HydrophobicContact CE1-CB 4.05Å; Y273-A299 HydrophobicContact CE2-CB 3.88Å; Y273-A299 HydrophobicContact CG-CB 3.86Å; Y273-L427 HydrophobicContact CD2-CB 4.34Å; Y273-L427 PolarHBondContact N-O 2.64Å; Y273-C428 CarbonylContact O-C 3.58Å; Y273-C428 VanDerWaalsContact O-CA 3.22Å; Y273-C428 WeakPolarHBondContact O-CA 3.38Å; Y273-E429 PolarHBondContact O-N 3.26Å
274	K	97.7	Very high	96.2	Very high	146 Å²	146	38.1 Å²	38.1	64%	0.635	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	-48.6	175.8	-60.1	180	176.1	-179.7	0	109.9	D298 E429 V430	K274-D298 WeakPolarHBondContact CA-OD2 3.23Å; K274-D298 VanDerWaalsContact CB-OD2 3.27Å; K274-D298 WeakPolarHBondContact CB-OD2 3.34Å; K274-D298 PolarHBondContact N-OD2 3.07Å; K274-E429 WeakPolarHBondContact O-CB 3.29Å; K274-V430 WeakPolarHBondContact O-CG1 3.25Å; K274-V430 PolarHBondContact O-N 3.42Å; K274-V430 VanDerWaalsContact O-N 3.12Å
275	S	98.4	Very high	96.4	Very high	28 Å²	28	33 Å²	33	20%	0.196	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136	-178	66.9	0	0	0	0	112.4	D298 A299	S275-D298 PolarHBondContact N-OD2 3.33Å; S275-D298 WeakPolarHBondContact O-CB 3.26Å; S275-D298 PolarHBondContact O-N 3.45Å; S275-A299 PolarHBondContact O-N 3.01Å
276	C	98.9	Very high	96.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.7	179.8	-66.7	0	0	0	0	112.6	Y273 H297 A299 M424 C428 V430 V431 H432	Y273-C276 VanDerWaalsContact CB-SG 3.51Å; C276-H297 PolarHBondContact O-CD2 3.38Å; C276-A299 CarbonylContact C-O 3.54Å; C276-A299 VanDerWaalsContact CA-O 3.28Å; C276-A299 WeakPolarHBondContact CA-O 3.44Å; C276-M424 HydrophobicContact CB-CE 3.6Å; C276-M424 VanDerWaalsContact SG-CE 3.56Å; C276-C428 HydrophobicContact CB-CB 3.65Å; C276-C428 WeakPolarHBondContact CB-SG 3.26Å; C276-C428 WeakPolarHBondContact SG-CB 3.29Å; C276-C428 CovalentContact SG-SG 2Å; C276-C428 PolarHBondContact SG-SG 3.22Å; C276-V430 PolarHBondContact N-O 3.1Å; C276-V431 CarbonylContact O-C 3.6Å; C276-V431 WeakPolarHBondContact O-CA 3.16Å; C276-H432 PolarHBondContact O-N 2.95Å
277	A	98.9	Very high	96.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.7	171.5	0	0	0	0	0	110.6	V279 I294 H297 A299 V300 L301 H432 Y434	A277-V279 HydrophobicContact CB-CG2 4.49Å; A277-I294 HydrophobicContact CB-CG2 4.23Å; A277-H297 HydrophobicContact CB-CB 4.08Å; A277-A299 PolarHBondContact N-O 3.11Å; A277-V300 HydrophobicContact CB-CG2 4.25Å; A277-V300 CarbonylContact O-C 3.58Å; A277-V300 WeakPolarHBondContact O-CA 3.39Å; A277-L301 PolarHBondContact O-N 3.18Å; A277-H432 CarbonylContact C-O 3.52Å; A277-H432 WeakPolarHBondContact CA-O 3.17Å; A277-Y434 HydrophobicContact CB-CD2 4.13Å; A277-Y434 HydrophobicContact CB-CE2 3.74Å
278	V	98.9	Very high	96.7	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.9	166.5	176.4	0	0	0	0	107.5	L301 F303 M424 V431 H432 V433 Y434	V278-L301 HydrophobicContact CG1-CD2 4.17Å; V278-L301 HydrophobicContact CG2-CB 4.46Å; V278-F303 HydrophobicContact CG1-CE2 3.83Å; V278-F303 HydrophobicContact CG1-CZ 3.63Å; V278-M424 HydrophobicContact CG2-CB 3.81Å; V278-M424 HydrophobicContact CG2-CG 3.53Å; V278-V431 HydrophobicContact CG2-CG1 3.69Å; V278-H432 PolarHBondContact N-O 2.82Å; V278-V433 HydrophobicContact CB-CB 4.43Å; V278-V433 HydrophobicContact CB-CG1 4.13Å; V278-V433 HydrophobicContact CB-CG2 4.23Å; V278-V433 HydrophobicContact CG1-CG1 4.09Å; V278-V433 WeakPolarHBondContact O-CA 3.46Å; V278-Y434 PolarHBondContact O-N 3.08Å
279	V	98.9	Very high	97	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	111	-177.2	-173.3	0	0	0	0	108.5	A277 L285 I294 V300 L301 F303 V315	A277-V279 HydrophobicContact CB-CG2 4.49Å; V279-L285 HydrophobicContact CG1-CD1 3.91Å; V279-I294 HydrophobicContact CG1-CD1 4.29Å; V279-I294 HydrophobicContact CG2-CD1 4Å; V279-I294 HydrophobicContact CG2-CG1 4.26Å; V279-I294 HydrophobicContact CG2-CG2 3.66Å; V279-V300 HydrophobicContact CG2-CG1 3.79Å; V279-L301 PolarHBondContact N-O 3.33Å; V279-F303 VanDerWaalsContact O-CD2 3.26Å; V279-F303 WeakPolarHBondContact O-CD2 3.43Å; V279-F303 VanDerWaalsContact O-CE2 3.29Å; V279-F303 WeakPolarHBondContact O-CE2 3.48Å; V279-V315 HydrophobicContact CG1-CB 4.42Å
280	S	98.5	Very high	97.4	Very high	11 Å²	11	34.7 Å²	34.7	8%	0.077	20%	0.204	C	C	.	.			trans	-62.5	172.7	174.5	92	0	0	0	0	111.1	A282 L285 Y434 E435	S280-A282 VanDerWaalsContact OG-CB 3.3Å; S280-A282 WeakPolarHBondContact OG-CB 3.27Å; S280-A282 PolarHBondContact OG-N 3.43Å; S280-A282 VanDerWaalsContact OG-N 3.1Å; S280-L285 WeakPolarHBondContact O-CD1 3.33Å; S280-Y434 VanDerWaalsContact CB-O 3.25Å; S280-Y434 WeakPolarHBondContact CB-O 3.5Å; S280-Y434 PolarHBondContact N-O 3.12Å; S280-Y434 VanDerWaalsContact N-O 3.14Å; S280-Y434 PolarHBondContact OG-O 3.18Å; S280-E435 WeakPolarHBondContact CB-O 3.5Å; S280-E435 VanDerWaalsContact OG-C 3.29Å; S280-E435 PolarHBondContact OG-O 2.72Å
281	S	98.6	Very high	97.6	Very high	16 Å²	16	34 Å²	34	11%	0.112	20%	0.2	C	C	.	.			trans	-95.9	5.9	173.8	-60.7	0	0	0	0	113	H447 Y448	S281-H447 WeakPolarHBondContact O-CA 3.3Å; S281-H447 PolarHBondContact O-CD2 3.11Å; S281-Y448 WeakPolarHBondContact O-CD1 3.23Å; S281-Y448 PolarHBondContact O-N 3.19Å
282	A	98.3	Very high	98	Very high	19 Å²	19	41.1 Å²	41.1	16%	0.157	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-61.6	146.5	-166.5	0	0	0	0	0	113.5	S280 S284 L285 E435	S280-A282 VanDerWaalsContact OG-CB 3.3Å; S280-A282 WeakPolarHBondContact OG-CB 3.27Å; S280-A282 PolarHBondContact OG-N 3.43Å; S280-A282 VanDerWaalsContact OG-N 3.1Å; A282-S284 PolarHBondContact O-N 3.39Å; A282-L285 WeakPolarHBondContact O-CB 3.38Å; A282-L285 PolarHBondContact O-N 2.88Å; A282-E435 HydrophobicContact CB-CB 4.27Å
283	G	97.9	Very high	98.3	Very high	3 Å²	3	38.3 Å²	38.3	3%	0.031	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-60.5	-22.7	175.3	0	0	0	0	0	114.6	L285 R286 L445 C446	G283-L285 PolarHBondContact O-N 3.29Å; G283-R286 WeakPolarHBondContact O-CB 3.42Å; G283-R286 PolarHBondContact O-N 3.45Å; G283-R286 VanDerWaalsContact O-N 3.12Å; G283-L445 VanDerWaalsContact CA-O 3.29Å; G283-L445 WeakPolarHBondContact CA-O 3.45Å; G283-L445 PolarHBondContact N-O 3.41Å; G283-C446 PolarHBondContact N-O 3.25Å
284	S	97.3	Very high	98.4	Very high	9 Å²	9	35.9 Å²	35.9	6%	0.063	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-68.2	-10.5	178.2	51.7	0	0	0	0	114.1	A282 R286 E435 R441	A282-S284 PolarHBondContact O-N 3.39Å; S284-R286 VanDerWaalsContact C-N 3.29Å; S284-E435 WeakPolarHBondContact CB-OE2 3.11Å; S284-E435 VanDerWaalsContact OG-CD 3.24Å; S284-E435 PolarHBondContact OG-OE2 3.18Å; S284-R441 WeakPolarHBondContact CB-O 3.49Å; S284-R441 WeakPolarHBondContact O-CD 3.36Å; S284-R441 PolarHBondContact O-NE 3.19Å; S284-R441 VanDerWaalsContact O-NE 3.14Å
285	L	98.5	Very high	98.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-69.4	-23.9	169.5	-75.2	163.8	0	0	0	112.8	V279 S280 A282 G283 N287 S288 L290 D314 V315 E435 Y448	V279-L285 HydrophobicContact CG1-CD1 3.91Å; S280-L285 WeakPolarHBondContact O-CD1 3.33Å; A282-L285 WeakPolarHBondContact O-CB 3.38Å; A282-L285 PolarHBondContact O-N 2.88Å; G283-L285 PolarHBondContact O-N 3.29Å; L285-N287 PolarHBondContact O-N 2.87Å; L285-S288 WeakPolarHBondContact O-CB 3.32Å; L285-S288 PolarHBondContact O-N 2.79Å; L285-S288 VanDerWaalsContact O-N 3.12Å; L285-S288 PolarHBondContact O-OG 3.15Å; L285-L290 HydrophobicContact CD2-CD1 4.17Å; L285-D314 VanDerWaalsContact O-CB 3.32Å; L285-D314 WeakPolarHBondContact O-CB 3.2Å; L285-V315 HydrophobicContact CB-CG1 4.08Å; L285-V315 HydrophobicContact CD1-CG1 4.19Å; L285-E435 HydrophobicContact CD1-CB 4.48Å; L285-E435 HydrophobicContact CD2-CB 3.98Å; L285-E435 HydrophobicContact CD2-CG 3.57Å; L285-E435 HydrophobicContact CG-CB 3.82Å; L285-E435 HydrophobicContact CG-CG 3.73Å; L285-Y448 HydrophobicContact CB-CD1 4.24Å; L285-Y448 HydrophobicContact CB-CG 4.42Å; L285-Y448 HydrophobicContact CD1-CD1 3.74Å; L285-Y448 HydrophobicContact CD1-CE1 4.06Å
286	R	96.8	Very high	98.4	Very high	73 Å²	73	34.5 Å²	34.5	28%	0.275	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	132.9	179.5	-79.4	-165.3	172.1	159	9.7	111.8	G283 S284 S288 L445 Y448 Q450	G283-R286 WeakPolarHBondContact O-CB 3.42Å; G283-R286 PolarHBondContact O-N 3.45Å; G283-R286 VanDerWaalsContact O-N 3.12Å; S284-R286 VanDerWaalsContact C-N 3.29Å; R286-S288 PolarHBondContact O-N 3.43Å; R286-L445 HydrophobicContact CG-CD2 4.39Å; R286-Y448 PolarHBondContact NE-O 3.47Å; R286-Y448 PolarHBondContact NH2-O 2.82Å; R286-Q450 PolarHBondContact NH2-O 2.92Å
287	N	97.2	Very high	98.4	Very high	141 Å²	141	34.9 Å²	34.9	75%	0.754	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	25.6	-177.3	-53.3	-59.1	0	0	0	113.7	L285 D314	L285-N287 PolarHBondContact O-N 2.87Å; N287-D314 VanDerWaalsContact C-OD1 3.29Å; N287-D314 WeakPolarHBondContact CA-OD1 3.4Å; N287-D314 WeakPolarHBondContact CA-OD2 3.47Å; N287-D314 PolarHBondContact N-OD1 3.46Å; N287-D314 PolarHBondContact N-OD2 2.73Å
288	S	98.3	Very high	98.4	Very high	21 Å²	21	38.5 Å²	38.5	15%	0.147	21%	0.211	C	C	.	.			trans	-76.4	-28.4	177.9	66.4	0	0	0	0	112.5	L285 R286 L290 D314	L285-S288 WeakPolarHBondContact O-CB 3.32Å; L285-S288 PolarHBondContact O-N 2.79Å; L285-S288 VanDerWaalsContact O-N 3.12Å; L285-S288 PolarHBondContact O-OG 3.15Å; R286-S288 PolarHBondContact O-N 3.43Å; S288-L290 PolarHBondContact O-N 3.01Å; S288-L290 PolarHBondContact OG-N 2.89Å; S288-D314 PolarHBondContact N-OD1 3.35Å; S288-D314 PolarHBondContact OG-O 3.18Å
289	G	98.5	Very high	98.4	Very high	41 Å²	41	38.4 Å²	38.4	42%	0.423	21%	0.211	S	C	.	.			trans	67.7	14.2	-174.4	0	0	0	0	0	114.7	G291 K313 D314	G289-G291 PolarHBondContact O-N 2.94Å; G289-K313 CarbonylContact C-O 3.24Å; G289-K313 VanDerWaalsContact C-O 3.24Å; G289-K313 VanDerWaalsContact CA-O 3.31Å; G289-K313 WeakPolarHBondContact CA-O 3.48Å; G289-D314 PolarHBondContact N-OD1 3.05Å
290	L	98.8	Very high	98.4	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.031	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-7.9	-175.1	-66.7	166.7	0	0	0	113.6	L285 S288 K292 E293 I294 Y434 H486	L285-L290 HydrophobicContact CD2-CD1 4.17Å; S288-L290 PolarHBondContact O-N 3.01Å; S288-L290 PolarHBondContact OG-N 2.89Å; L290-K292 VanDerWaalsContact C-N 3.33Å; L290-K292 PolarHBondContact O-N 2.84Å; L290-E293 WeakPolarHBondContact O-CB 3.34Å; L290-E293 PolarHBondContact O-N 3.15Å; L290-I294 HydrophobicContact CB-CD1 3.95Å; L290-I294 HydrophobicContact CB-CG1 4.4Å; L290-I294 WeakPolarHBondContact O-CG1 3.45Å; L290-I294 PolarHBondContact O-N 3.35Å; L290-Y434 HydrophobicContact CD1-CD1 4.09Å; L290-Y434 HydrophobicContact CD2-CE1 4.42Å; L290-H486 WeakPolarHBondContact CD1-O 2.98Å; L290-H486 HydrophobicContact CD2-CB 3.99Å
291	G	98.8	Very high	98.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-38.3	-168	0	0	0	0	0	114.7	G289 I294 D295 E312 K313 D314 G316	G289-G291 PolarHBondContact O-N 2.94Å; G291-I294 PolarHBondContact O-N 2.83Å; G291-D295 WeakPolarHBondContact O-CB 3.42Å; G291-D295 PolarHBondContact O-N 2.9Å; G291-E312 WeakPolarHBondContact CA-O 3.35Å; G291-K313 WeakPolarHBondContact CA-O 3.42Å; G291-K313 PolarHBondContact N-O 3.38Å; G291-D314 PolarHBondContact N-O 2.98Å; G291-G316 WeakPolarHBondContact O-CA 3.12Å
292	K	98.7	Very high	98.4	Very high	186 Å²	186	37.1 Å²	37.1	81%	0.809	20%	0.202	S	C	*	.	H	α-helix	trans	-64.7	-41.9	175.7	-71.1	-172.4	178.7	-175.3	0	112.3	L290 D295 T296	L290-K292 VanDerWaalsContact C-N 3.33Å; L290-K292 PolarHBondContact O-N 2.84Å; K292-D295 PolarHBondContact O-N 2.93Å; K292-T296 VanDerWaalsContact O-CG2 3.27Å; K292-T296 WeakPolarHBondContact O-CG2 3.27Å; K292-T296 PolarHBondContact O-N 2.02Å
293	E	98.6	Very high	98.5	Very high	50 Å²	50	36.6 Å²	36.6	23%	0.234	20%	0.196	C	C	.	.	H	α-helix	trans	-67.5	-42.2	178.2	-173.1	-170.4	133.9	0	0	111.2	L290 D295 T296 H297 Y434 R488	L290-E293 WeakPolarHBondContact O-CB 3.34Å; L290-E293 PolarHBondContact O-N 3.15Å; E293-D295 VanDerWaalsContact C-N 3.3Å; E293-D295 PolarHBondContact O-N 3.2Å; E293-T296 PolarHBondContact O-N 2.89Å; E293-T296 PolarHBondContact O-OG1 3.32Å; E293-H297 PolarHBondContact O-CE1 3.46Å; E293-H297 PolarHBondContact O-ND1 2.78Å; E293-H297 VanDerWaalsContact O-ND1 3.09Å; E293-Y434 VanDerWaalsContact OE1-CE1 3.27Å; E293-Y434 WeakPolarHBondContact OE1-CE1 3.44Å; E293-Y434 PolarHBondContact OE1-OH 2.56Å; E293-R488 VanDerWaalsContact OE1-CD 3.24Å; E293-R488 WeakPolarHBondContact OE1-CD 3.35Å; E293-R488 IonicContact OE1-CZ 3.63Å; E293-R488 IonicContact OE1-NE 3.48Å; E293-R488 IonicContact OE1-NH1 2.71Å; E293-R488 PolarHBondContact OE1-NH1 3.44Å; E293-R488 IonicContact OE2-NH1 3.77Å
294	I	98.9	Very high	98.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.3	-46.1	175.6	-70.4	165.2	0	0	0	110.1	A277 V279 L290 G291 T296 H297 V300 Y434	A277-I294 HydrophobicContact CB-CG2 4.23Å; V279-I294 HydrophobicContact CG1-CD1 4.29Å; V279-I294 HydrophobicContact CG2-CD1 4Å; V279-I294 HydrophobicContact CG2-CG1 4.26Å; V279-I294 HydrophobicContact CG2-CG2 3.66Å; L290-I294 HydrophobicContact CB-CD1 3.95Å; L290-I294 HydrophobicContact CB-CG1 4.4Å; L290-I294 WeakPolarHBondContact O-CG1 3.45Å; L290-I294 PolarHBondContact O-N 3.35Å; G291-I294 PolarHBondContact O-N 2.83Å; I294-T296 PolarHBondContact O-N 2.96Å; I294-H297 PolarHBondContact O-N 3.16Å; I294-H297 PolarHBondContact O-ND1 2.96Å; I294-V300 HydrophobicContact CG2-CG1 3.97Å; I294-V300 HydrophobicContact CG2-CG2 4.05Å; I294-Y434 HydrophobicContact CG1-CD1 4.44Å; I294-Y434 HydrophobicContact CG1-CD2 4.08Å; I294-Y434 HydrophobicContact CG1-CE1 4.38Å; I294-Y434 HydrophobicContact CG1-CE2 4.03Å; I294-Y434 HydrophobicContact CG1-CG 4.28Å
295	D	98.9	Very high	98.5	Very high	41 Å²	41	38 Å²	38	22%	0.219	20%	0.204	C	C	.	.	H	α-helix	trans	-69.7	-12.7	-177.1	-76.8	-11	0	0	0	113.8	G291 K292 E293 H297 G316 S317 K318	G291-D295 WeakPolarHBondContact O-CB 3.42Å; G291-D295 PolarHBondContact O-N 2.9Å; K292-D295 PolarHBondContact O-N 2.93Å; E293-D295 VanDerWaalsContact C-N 3.3Å; E293-D295 PolarHBondContact O-N 3.2Å; D295-H297 VanDerWaalsContact C-N 3.26Å; D295-H297 PolarHBondContact O-N 3.25Å; D295-G316 WeakPolarHBondContact OD1-CA 3.49Å; D295-S317 VanDerWaalsContact CG-N 3.32Å; D295-S317 PolarHBondContact OD1-N 3.11Å; D295-S317 PolarHBondContact OD2-N 3.17Å; D295-S317 PolarHBondContact OD2-OG 2.99Å; D295-K318 PolarHBondContact O-NZ 2.8Å; D295-K318 VanDerWaalsContact OD1-CB 3.31Å; D295-K318 WeakPolarHBondContact OD1-CB 3.5Å; D295-K318 PolarHBondContact OD1-N 2.76Å
296	T	98.8	Very high	98.5	Very high	103 Å²	103	38.1 Å²	38.1	63%	0.632	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-15.3	174	69.8	0	0	0	0	113.8	K292 E293 I294	K292-T296 VanDerWaalsContact O-CG2 3.27Å; K292-T296 WeakPolarHBondContact O-CG2 3.27Å; K292-T296 PolarHBondContact O-N 2.02Å; E293-T296 PolarHBondContact O-N 2.89Å; E293-T296 PolarHBondContact O-OG1 3.32Å; I294-T296 PolarHBondContact O-N 2.96Å
297	H	98.9	Very high	98.5	Very high	8 Å²	8	36 Å²	36	4%	0.037	20%	0.201	C	C	.	.	S	Bend	trans	-75.2	151.8	-179.7	-66.8	74.3	0	0	0	111.5	C276 A277 E293 I294 D295 K318 H432 Y434	C276-H297 PolarHBondContact O-CD2 3.38Å; A277-H297 HydrophobicContact CB-CB 4.08Å; E293-H297 PolarHBondContact O-CE1 3.46Å; E293-H297 PolarHBondContact O-ND1 2.78Å; E293-H297 VanDerWaalsContact O-ND1 3.09Å; I294-H297 PolarHBondContact O-N 3.16Å; I294-H297 PolarHBondContact O-ND1 2.96Å; D295-H297 VanDerWaalsContact C-N 3.26Å; D295-H297 PolarHBondContact O-N 3.25Å; H297-K318 PolarHBondContact O-NZ 3.44Å; H297-H432 AromaticContact CD2-ND1 3.76Å; H297-H432 AromaticContact CE1-ND1 3.92Å; H297-H432 AromaticContact NE2-CE1 3.87Å; H297-H432 AromaticContact NE2-CG 3.53Å; H297-H432 AromaticContact NE2-ND1 2.87Å; H297-H432 PolarHBondContact NE2-ND1 3.45Å; H297-Y434 PolarHBondContact CE1-OH 2.82Å
298	D	98.6	Very high	98.6	Very high	76 Å²	76	30.7 Å²	30.7	41%	0.406	17%	0.173	S	C	.	.	S	Bend	trans	-65.4	-43	179.3	-56.1	-45.3	0	0	0	110.7	Y273 K274 S275	Y273-D298 HydrophobicContact CD1-CB 3.97Å; Y273-D298 HydrophobicContact CG-CB 4.44Å; K274-D298 WeakPolarHBondContact CA-OD2 3.23Å; K274-D298 VanDerWaalsContact CB-OD2 3.27Å; K274-D298 WeakPolarHBondContact CB-OD2 3.34Å; K274-D298 PolarHBondContact N-OD2 3.07Å; S275-D298 PolarHBondContact N-OD2 3.33Å; S275-D298 WeakPolarHBondContact O-CB 3.26Å; S275-D298 PolarHBondContact O-N 3.45Å
299	A	98.8	Very high	98.6	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.8	176.7	0	0	0	0	0	113	Y273 S275 C276 A277 T320 M424	Y273-A299 HydrophobicContact CD1-CB 3.99Å; Y273-A299 HydrophobicContact CD2-CB 3.8Å; Y273-A299 HydrophobicContact CE1-CB 4.05Å; Y273-A299 HydrophobicContact CE2-CB 3.88Å; Y273-A299 HydrophobicContact CG-CB 3.86Å; S275-A299 PolarHBondContact O-N 3.01Å; C276-A299 CarbonylContact C-O 3.54Å; C276-A299 VanDerWaalsContact CA-O 3.28Å; C276-A299 WeakPolarHBondContact CA-O 3.44Å; A277-A299 PolarHBondContact N-O 3.11Å; A299-T320 WeakPolarHBondContact CA-OG1 3.04Å; A299-T320 HydrophobicContact CB-CG2 3.89Å; A299-M424 HydrophobicContact CB-CE 4Å
300	V	98.9	Very high	98.5	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.8	177.2	-179.4	0	0	0	0	109.9	A277 V279 I294 R302 K318 T320 V321	A277-V300 HydrophobicContact CB-CG2 4.25Å; A277-V300 CarbonylContact O-C 3.58Å; A277-V300 WeakPolarHBondContact O-CA 3.39Å; V279-V300 HydrophobicContact CG2-CG1 3.79Å; I294-V300 HydrophobicContact CG2-CG1 3.97Å; I294-V300 HydrophobicContact CG2-CG2 4.05Å; V300-R302 HydrophobicContact CG1-CG 4.26Å; V300-K318 HydrophobicContact CB-CB 4.46Å; V300-K318 HydrophobicContact CB-CG 4.3Å; V300-K318 WeakPolarHBondContact CG1-O 3.11Å; V300-K318 HydrophobicContact CG2-CB 4.02Å; V300-K318 HydrophobicContact CG2-CD 3.77Å; V300-K318 HydrophobicContact CG2-CG 3.97Å; V300-T320 PolarHBondContact N-OG1 3.03Å; V300-T320 VanDerWaalsContact N-OG1 3.12Å; V300-T320 PolarHBondContact O-N 3.41Å; V300-V321 PolarHBondContact O-N 3.16Å; V300-V321 VanDerWaalsContact O-N 3.09Å
301	L	98.9	Very high	98.5	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132.5	173.5	-175	143.9	0	0	0	111.2	A277 V278 V279 F303 V321 L423 M424	A277-L301 PolarHBondContact O-N 3.18Å; V278-L301 HydrophobicContact CG1-CD2 4.17Å; V278-L301 HydrophobicContact CG2-CB 4.46Å; V279-L301 PolarHBondContact N-O 3.33Å; L301-F303 HydrophobicContact CD2-CD1 4.06Å; L301-F303 HydrophobicContact CD2-CE1 3.3Å; L301-F303 HydrophobicContact CD2-CE2 3.9Å; L301-F303 HydrophobicContact CD2-CZ 3.22Å; L301-V321 VanDerWaalsContact CA-O 3.27Å; L301-V321 WeakPolarHBondContact CA-O 3.3Å; L301-V321 HydrophobicContact CB-CB 4.4Å; L301-V321 HydrophobicContact CD1-CB 4.12Å; L301-V321 HydrophobicContact CD1-CG1 3.81Å; L301-V321 HydrophobicContact CG-CB 4.31Å; L301-V321 HydrophobicContact CG-CG1 4.37Å; L301-L423 HydrophobicContact CD1-CD2 3.99Å; L301-M424 HydrophobicContact CB-CE 4.24Å; L301-M424 HydrophobicContact CB-CG 3.74Å; L301-M424 HydrophobicContact CB-SD 3.73Å; L301-M424 HydrophobicContact CD1-CG 3.74Å; L301-M424 HydrophobicContact CD1-SD 3.57Å; L301-M424 VanDerWaalsContact CD1-SD 3.57Å; L301-M424 HydrophobicContact CG-CG 4.27Å; L301-M424 HydrophobicContact CG-SD 4.26Å
302	R	98.9	Very high	98.5	Very high	2 Å²	2	41 Å²	41	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	166.4	175.4	-59.3	-172.7	-171.5	-88.1	-4.6	111.7	V300 T308 V315 G316 K318 T319 V321 R322 L323	V300-R302 HydrophobicContact CG1-CG 4.26Å; R302-T308 VanDerWaalsContact NE-CG2 3.34Å; R302-V315 PolarHBondContact NH1-O 3.42Å; R302-V315 PolarHBondContact NH2-O 3.1Å; R302-G316 PolarHBondContact NH2-O 2.75Å; R302-K318 PolarHBondContact NE-O 3.09Å; R302-K318 PolarHBondContact NH2-O 3.41Å; R302-T319 HydrophobicContact CB-CG2 4.36Å; R302-T319 VanDerWaalsContact CD-OG1 3.29Å; R302-T319 WeakPolarHBondContact CD-OG1 3.01Å; R302-T319 HydrophobicContact CG-CG2 4.26Å; R302-T319 PolarHBondContact NE-OG1 2.67Å; R302-T319 VanDerWaalsContact NE-OG1 3.12Å; R302-V321 PolarHBondContact N-O 3.32Å; R302-R322 CarbonylContact O-C 3.55Å; R302-R322 WeakPolarHBondContact O-CA 3.41Å; R302-L323 PolarHBondContact O-N 3.28Å
303	F	98.8	Very high	98.5	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.3	-173.8	-56.6	-74.6	0	0	0	113.2	V278 V279 L301 A305 A306 R322 L323 S416	V278-F303 HydrophobicContact CG1-CE2 3.83Å; V278-F303 HydrophobicContact CG1-CZ 3.63Å; V279-F303 VanDerWaalsContact O-CD2 3.26Å; V279-F303 WeakPolarHBondContact O-CD2 3.43Å; V279-F303 VanDerWaalsContact O-CE2 3.29Å; V279-F303 WeakPolarHBondContact O-CE2 3.48Å; L301-F303 HydrophobicContact CD2-CD1 4.06Å; L301-F303 HydrophobicContact CD2-CE1 3.3Å; L301-F303 HydrophobicContact CD2-CE2 3.9Å; L301-F303 HydrophobicContact CD2-CZ 3.22Å; F303-A305 PolarHBondContact O-N 3.34Å; F303-A306 WeakPolarHBondContact O-CB 3.41Å; F303-A306 PolarHBondContact O-N 3.11Å; F303-R322 PolarHBondContact O-NH1 3.18Å; F303-L323 CarbonylContact C-O 3.53Å; F303-L323 WeakPolarHBondContact CA-O 3.36Å; F303-L323 HydrophobicContact CD1-CB 4.05Å; F303-L323 HydrophobicContact CD1-CD2 4.29Å; F303-L323 HydrophobicContact CE1-CB 4.27Å; F303-L323 HydrophobicContact CE1-CD2 4.05Å; F303-S416 WeakPolarHBondContact CE1-O 3.41Å
304	N	98.4	Very high	98.5	Very high	28 Å²	28	38.2 Å²	38.2	15%	0.15	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	-128	164.5	-62.4	-38.1	0	0	0	112.3	A306 R322 L323 I324 N325 V328 Y342	N304-A306 VanDerWaalsContact C-N 3.34Å; N304-R322 WeakPolarHBondContact O-CD 3.32Å; N304-R322 PolarHBondContact O-NH1 3.24Å; N304-L323 PolarHBondContact N-O 3.48Å; N304-I324 WeakPolarHBondContact OD1-CA 3.41Å; N304-N325 PolarHBondContact OD1-N 2.56Å; N304-V328 HydrophobicContact CB-CG2 3.92Å; N304-Y342 WeakPolarHBondContact O-CE1 3.46Å
305	A	97.2	Very high	98.5	Very high	15 Å²	15	38.2 Å²	38.2	12%	0.124	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	17.7	-179	0	0	0	0	0	114.2	F303 P307 L341 Y342	F303-A305 PolarHBondContact O-N 3.34Å; A305-P307 WeakPolarHBondContact O-CD 3.29Å; A305-L341 HydrophobicContact CB-CD2 4.33Å; A305-L341 WeakPolarHBondContact O-CD2 3.43Å; A305-Y342 WeakPolarHBondContact CB-OH 3.41Å
306	A	98.1	Very high	98.5	Very high	2 Å²	2	36.2 Å²	36.2	2%	0.017	21%	0.211	C	C	.	.			trans	-68.5	111.9	-178.2	0	0	0	0	0	111.2	F303 N304 R322 Y448 Y449	F303-A306 WeakPolarHBondContact O-CB 3.41Å; F303-A306 PolarHBondContact O-N 3.11Å; N304-A306 VanDerWaalsContact C-N 3.34Å; A306-R322 PolarHBondContact O-NH1 2.83Å; A306-R322 PolarHBondContact O-NH2 3.14Å; A306-Y448 HydrophobicContact CB-CE1 4.24Å; A306-Y448 WeakPolarHBondContact CB-OH 3.17Å; A306-Y449 HydrophobicContact CB-CD1 4.39Å; A306-Y449 HydrophobicContact CB-CE1 3.8Å
307	P	98	Very high	98.5	Very high	28 Å²	28	34.8 Å²	34.8	18%	0.182	21%	0.205	C	C	.	.			trans	-85.6	156.1	-174.8	35.4	-33.1	0	0	0	112	A305 F311 L341 Y448 Y449	A305-P307 WeakPolarHBondContact O-CD 3.29Å; P307-F311 HydrophobicContact CG-CD2 4.07Å; P307-F311 HydrophobicContact CG-CE2 4.08Å; P307-L341 HydrophobicContact CB-CD1 4.38Å; P307-Y448 HydrophobicContact CG-CE2 4.36Å; P307-Y448 VanDerWaalsContact O-CE2 3.31Å; P307-Y448 WeakPolarHBondContact O-CE2 3.5Å; P307-Y448 PolarHBondContact O-OH 3.46Å; P307-Y449 VanDerWaalsContact CD-CD1 3.45Å; P307-Y449 HydrophobicContact CG-CD1 4.44Å; P307-Y449 HydrophobicContact CG-CD2 4.46Å; P307-Y449 HydrophobicContact CG-CG 3.95Å
308	T	98.3	Very high	98.5	Very high	29 Å²	29	37.9 Å²	37.9	18%	0.178	22%	0.218	C	C	.	.			trans	-96	-39	166.3	48.5	0	0	0	0	111.5	R302 G310 F311 E312 G316	R302-T308 VanDerWaalsContact NE-CG2 3.34Å; T308-G310 PolarHBondContact O-N 3.32Å; T308-F311 CarbonylContact O-C 3.42Å; T308-F311 WeakPolarHBondContact O-CA 3.49Å; T308-F311 PolarHBondContact O-N 2.82Å; T308-E312 VanDerWaalsContact O-CD 3.29Å; T308-E312 PolarHBondContact O-N 2.99Å; T308-G316 WeakPolarHBondContact CG2-O 3.35Å
309	S	97.9	Very high	98.5	Very high	92 Å²	92	35.5 Å²	35.5	64%	0.643	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	122.7	-178.8	-167.7	0	0	0	0	112	F311 E312	S309-F311 VanDerWaalsContact C-N 3.27Å; S309-F311 WeakPolarHBondContact O-CD2 3.36Å; S309-F311 PolarHBondContact O-N 3.23Å; S309-E312 VanDerWaalsContact CA-OE1 3.23Å; S309-E312 WeakPolarHBondContact CA-OE1 3.3Å
310	G	98	Very high	98.5	Very high	60 Å²	60	37 Å²	37	62%	0.619	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	0.9	-179.3	0	0	0	0	0	115	T308 E312	T308-G310 PolarHBondContact O-N 3.32Å; G310-E312 WeakPolarHBondContact CA-OE2 3.48Å; G310-E312 VanDerWaalsContact N-CD 3.31Å; G310-E312 PolarHBondContact N-OE1 2.92Å; G310-E312 VanDerWaalsContact N-OE1 3.09Å; G310-E312 PolarHBondContact N-OE2 3.21Å
311	F	98.6	Very high	98.5	Very high	50 Å²	50	37 Å²	37	22%	0.219	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.8	8.9	178.9	-61.5	-80.7	0	0	0	112.7	P307 T308 S309 K313 D314 V315 Y448	P307-F311 HydrophobicContact CG-CD2 4.07Å; P307-F311 HydrophobicContact CG-CE2 4.08Å; T308-F311 CarbonylContact O-C 3.42Å; T308-F311 WeakPolarHBondContact O-CA 3.49Å; T308-F311 PolarHBondContact O-N 2.82Å; S309-F311 VanDerWaalsContact C-N 3.27Å; S309-F311 WeakPolarHBondContact O-CD2 3.36Å; S309-F311 PolarHBondContact O-N 3.23Å; F311-K313 PolarHBondContact O-N 3.43Å; F311-K313 VanDerWaalsContact O-N 3.11Å; F311-D314 PolarHBondContact O-N 2.98Å; F311-V315 HydrophobicContact CB-CG1 4.44Å; F311-V315 HydrophobicContact CB-CG2 3.77Å; F311-V315 WeakPolarHBondContact O-CG2 3.32Å; F311-V315 PolarHBondContact O-N 2.55Å; F311-Y448 HydrophobicContact CB-CD2 4.24Å; F311-Y448 HydrophobicContact CB-CE2 4.08Å; F311-Y448 AromaticContact CD1-CD2 3.8Å; F311-Y448 HydrophobicContact CD1-CD2 3.8Å; F311-Y448 HydrophobicContact CD1-CE2 4.36Å; F311-Y448 HydrophobicContact CD2-CD2 4.2Å; F311-Y448 HydrophobicContact CD2-CE2 4.02Å; F311-Y448 HydrophobicContact CE1-CD2 4.2Å; F311-Y448 WeakPolarHBondContact CE1-O 3.38Å; F311-Y448 AromaticContact CG-CD2 3.8Å; F311-Y448 HydrophobicContact CG-CD2 3.8Å; F311-Y448 AromaticContact CG-CE2 3.88Å; F311-Y448 HydrophobicContact CG-CE2 3.88Å
312	E	98.7	Very high	98.5	Very high	84 Å²	84	37.1 Å²	37.1	39%	0.393	22%	0.216	S	C	.	.	H	α-helix	trans	-57.7	-35.2	-169	-60.4	85.1	166.8	0	0	112.4	G291 T308 S309 G310 D314 G316	G291-E312 WeakPolarHBondContact CA-O 3.35Å; T308-E312 VanDerWaalsContact O-CD 3.29Å; T308-E312 PolarHBondContact O-N 2.99Å; S309-E312 VanDerWaalsContact CA-OE1 3.23Å; S309-E312 WeakPolarHBondContact CA-OE1 3.3Å; G310-E312 WeakPolarHBondContact CA-OE2 3.48Å; G310-E312 VanDerWaalsContact N-CD 3.31Å; G310-E312 PolarHBondContact N-OE1 2.92Å; G310-E312 VanDerWaalsContact N-OE1 3.09Å; G310-E312 PolarHBondContact N-OE2 3.21Å; E312-D314 PolarHBondContact O-N 3.34Å; E312-G316 VanDerWaalsContact O-CA 3.23Å; E312-G316 WeakPolarHBondContact O-CA 3.45Å; E312-G316 PolarHBondContact O-N 2.82Å
313	K	98.8	Very high	98.5	Very high	162 Å²	162	37 Å²	37	70%	0.704	22%	0.215	S	C	*	.	H	α-helix	trans	-58.2	-35.6	175.6	-178	-179.1	176.4	-174.9	0	112.5	G289 G291 F311	G289-K313 CarbonylContact C-O 3.24Å; G289-K313 VanDerWaalsContact C-O 3.24Å; G289-K313 VanDerWaalsContact CA-O 3.31Å; G289-K313 WeakPolarHBondContact CA-O 3.48Å; G291-K313 WeakPolarHBondContact CA-O 3.42Å; G291-K313 PolarHBondContact N-O 3.38Å; F311-K313 PolarHBondContact O-N 3.43Å; F311-K313 VanDerWaalsContact O-N 3.11Å
314	D	98.8	Very high	98.4	Very high	15 Å²	15	36.7 Å²	36.7	8%	0.08	21%	0.214	C	C	.	.	H	α-helix	trans	-97.9	-38.7	-173.1	-71.9	-28.5	0	0	0	112.2	L285 N287 S288 G289 G291 F311 E312	L285-D314 VanDerWaalsContact O-CB 3.32Å; L285-D314 WeakPolarHBondContact O-CB 3.2Å; N287-D314 VanDerWaalsContact C-OD1 3.29Å; N287-D314 WeakPolarHBondContact CA-OD1 3.4Å; N287-D314 WeakPolarHBondContact CA-OD2 3.47Å; N287-D314 PolarHBondContact N-OD1 3.46Å; N287-D314 PolarHBondContact N-OD2 2.73Å; S288-D314 PolarHBondContact N-OD1 3.35Å; S288-D314 PolarHBondContact OG-O 3.18Å; G289-D314 PolarHBondContact N-OD1 3.05Å; G291-D314 PolarHBondContact N-O 2.98Å; F311-D314 PolarHBondContact O-N 2.98Å; E312-D314 PolarHBondContact O-N 3.34Å
315	V	98.8	Very high	98.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-116.3	-4.5	-170.8	-50.8	0	0	0	0	113.7	V279 L285 R302 F311 Y448	V279-V315 HydrophobicContact CG1-CB 4.42Å; L285-V315 HydrophobicContact CB-CG1 4.08Å; L285-V315 HydrophobicContact CD1-CG1 4.19Å; R302-V315 PolarHBondContact NH1-O 3.42Å; R302-V315 PolarHBondContact NH2-O 3.1Å; F311-V315 HydrophobicContact CB-CG1 4.44Å; F311-V315 HydrophobicContact CB-CG2 3.77Å; F311-V315 WeakPolarHBondContact O-CG2 3.32Å; F311-V315 PolarHBondContact O-N 2.55Å; V315-Y448 HydrophobicContact CG1-CD1 4.22Å; V315-Y448 HydrophobicContact CG1-CD2 4.15Å; V315-Y448 HydrophobicContact CG1-CE1 4.07Å; V315-Y448 HydrophobicContact CG1-CE2 4.01Å; V315-Y448 HydrophobicContact CG1-CG 4.26Å; V315-Y448 HydrophobicContact CG2-CE2 4.3Å
316	G	98.7	Very high	98.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.208	C	C	.	.			trans	80.5	175.3	-176	0	0	0	0	0	112.6	G291 D295 R302 T308 E312	G291-G316 WeakPolarHBondContact O-CA 3.12Å; D295-G316 WeakPolarHBondContact OD1-CA 3.49Å; R302-G316 PolarHBondContact NH2-O 2.75Å; T308-G316 WeakPolarHBondContact CG2-O 3.35Å; E312-G316 VanDerWaalsContact O-CA 3.23Å; E312-G316 WeakPolarHBondContact O-CA 3.45Å; E312-G316 PolarHBondContact O-N 2.82Å
317	S	98.3	Very high	98.5	Very high	73 Å²	73	40.4 Å²	40.4	51%	0.51	23%	0.228	S	C	.	.	S	Bend	trans	-107.9	-24.3	-177.6	62.1	0	0	0	0	112.9	D295	D295-S317 VanDerWaalsContact CG-N 3.32Å; D295-S317 PolarHBondContact OD1-N 3.11Å; D295-S317 PolarHBondContact OD2-N 3.17Å; D295-S317 PolarHBondContact OD2-OG 2.99Å
318	K	98.5	Very high	98.5	Very high	72 Å²	72	39.4 Å²	39.4	31%	0.313	22%	0.222	S	C	.	.			trans	-75.3	137.9	-175.9	-173.8	-178.2	-73.4	167.6	0	111.6	D295 H297 V300 R302	D295-K318 PolarHBondContact O-NZ 2.8Å; D295-K318 VanDerWaalsContact OD1-CB 3.31Å; D295-K318 WeakPolarHBondContact OD1-CB 3.5Å; D295-K318 PolarHBondContact OD1-N 2.76Å; H297-K318 PolarHBondContact O-NZ 3.44Å; V300-K318 HydrophobicContact CB-CB 4.46Å; V300-K318 HydrophobicContact CB-CG 4.3Å; V300-K318 WeakPolarHBondContact CG1-O 3.11Å; V300-K318 HydrophobicContact CG2-CB 4.02Å; V300-K318 HydrophobicContact CG2-CD 3.77Å; V300-K318 HydrophobicContact CG2-CG 3.97Å; R302-K318 PolarHBondContact NE-O 3.09Å; R302-K318 PolarHBondContact NH2-O 3.41Å
319	T	98.6	Very high	98.4	Very high	27 Å²	27	38.2 Å²	38.2	17%	0.166	21%	0.214	C	C	.	.			trans	-139.1	111.6	166.7	-54.6	0	0	0	0	108	R302 R322	R302-T319 HydrophobicContact CB-CG2 4.36Å; R302-T319 VanDerWaalsContact CD-OG1 3.29Å; R302-T319 WeakPolarHBondContact CD-OG1 3.01Å; R302-T319 HydrophobicContact CG-CG2 4.26Å; R302-T319 PolarHBondContact NE-OG1 2.67Å; R302-T319 VanDerWaalsContact NE-OG1 3.12Å; T319-R322 HydrophobicContact CG2-CB 4.38Å
320	T	98.7	Very high	98.4	Very high	30 Å²	30	35.1 Å²	35.1	18%	0.184	19%	0.194	C	C	.	.	S	Bend	trans	-96.6	-43.8	178.6	-48.6	0	0	0	0	110.5	A299 V300 V346	A299-T320 WeakPolarHBondContact CA-OG1 3.04Å; A299-T320 HydrophobicContact CB-CG2 3.89Å; V300-T320 PolarHBondContact N-OG1 3.03Å; V300-T320 VanDerWaalsContact N-OG1 3.12Å; V300-T320 PolarHBondContact O-N 3.41Å; T320-V346 PolarHBondContact O-N 3.18Å
321	V	98.8	Very high	98.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138	179	-175.6	0	0	0	0	109.2	L270 V300 L301 R302 V346 V348	L270-V321 HydrophobicContact CD1-CG2 4.15Å; V300-V321 PolarHBondContact O-N 3.16Å; V300-V321 VanDerWaalsContact O-N 3.09Å; L301-V321 VanDerWaalsContact CA-O 3.27Å; L301-V321 WeakPolarHBondContact CA-O 3.3Å; L301-V321 HydrophobicContact CB-CB 4.4Å; L301-V321 HydrophobicContact CD1-CB 4.12Å; L301-V321 HydrophobicContact CD1-CG1 3.81Å; L301-V321 HydrophobicContact CG-CB 4.31Å; L301-V321 HydrophobicContact CG-CG1 4.37Å; R302-V321 PolarHBondContact N-O 3.32Å; V321-V346 CarbonylContact C-O 3.56Å; V321-V346 WeakPolarHBondContact CA-O 3.24Å; V321-V346 HydrophobicContact CG2-CB 4.5Å; V321-V348 HydrophobicContact CG1-CG2 3.77Å
322	R	98.9	Very high	97.9	Very high	3 Å²	3	38.2 Å²	38.2	1%	0.011	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	114.8	172	-176.8	174.4	-72.1	-80.3	-4.7	110.4	R302 F303 N304 A306 T319 I324 V346 L347 V348	R302-R322 CarbonylContact O-C 3.55Å; R302-R322 WeakPolarHBondContact O-CA 3.41Å; F303-R322 PolarHBondContact O-NH1 3.18Å; N304-R322 WeakPolarHBondContact O-CD 3.32Å; N304-R322 PolarHBondContact O-NH1 3.24Å; A306-R322 PolarHBondContact O-NH1 2.83Å; A306-R322 PolarHBondContact O-NH2 3.14Å; T319-R322 HydrophobicContact CG2-CB 4.38Å; R322-I324 HydrophobicContact CG-CD1 4.17Å; R322-I324 HydrophobicContact CG-CG1 3.82Å; R322-V346 PolarHBondContact N-O 3.06Å; R322-L347 HydrophobicContact CB-CD2 3.88Å; R322-L347 HydrophobicContact CG-CD2 4.45Å; R322-V348 PolarHBondContact O-N 3.41Å
323	L	98.9	Very high	97.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.6	174.5	-177.7	65.1	0	0	0	110	R302 F303 N304 V348 W350 L389 S416 L419	R302-L323 PolarHBondContact O-N 3.28Å; F303-L323 CarbonylContact C-O 3.53Å; F303-L323 WeakPolarHBondContact CA-O 3.36Å; F303-L323 HydrophobicContact CD1-CB 4.05Å; F303-L323 HydrophobicContact CD1-CD2 4.29Å; F303-L323 HydrophobicContact CE1-CB 4.27Å; F303-L323 HydrophobicContact CE1-CD2 4.05Å; N304-L323 PolarHBondContact N-O 3.48Å; L323-V348 CarbonylContact C-O 3.52Å; L323-V348 WeakPolarHBondContact CA-O 2.98Å; L323-V348 HydrophobicContact CD1-CB 3.89Å; L323-V348 HydrophobicContact CD1-CG1 3.67Å; L323-V348 WeakPolarHBondContact CD1-O 3.36Å; L323-W350 HydrophobicContact CD1-CG 4.47Å; L323-L389 HydrophobicContact CD1-CD1 3.66Å; L323-L389 HydrophobicContact CD1-CG 4.45Å; L323-S416 WeakPolarHBondContact CD2-O 3.14Å; L323-L419 HydrophobicContact CD2-CB 4.03Å
324	I	98.5	Very high	97.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.9	-171.9	-51.1	175.2	0	0	0	108.7	N304 R322 V328 M329 F336 Y342 L347 V348 A349 W350	N304-I324 WeakPolarHBondContact OD1-CA 3.41Å; R322-I324 HydrophobicContact CG-CD1 4.17Å; R322-I324 HydrophobicContact CG-CG1 3.82Å; I324-V328 HydrophobicContact CG2-CB 3.82Å; I324-V328 HydrophobicContact CG2-CG1 3.65Å; I324-M329 HydrophobicContact CG2-CG 3.87Å; I324-F336 HydrophobicContact CD1-CD2 4.42Å; I324-F336 HydrophobicContact CD1-CE2 3.82Å; I324-Y342 HydrophobicContact CD1-CD1 3.51Å; I324-Y342 HydrophobicContact CD1-CE1 3.73Å; I324-Y342 HydrophobicContact CG1-CE1 4.38Å; I324-L347 HydrophobicContact CD1-CD1 4.3Å; I324-L347 HydrophobicContact CD1-CD2 3.98Å; I324-V348 PolarHBondContact N-O 3.4Å; I324-A349 CarbonylContact O-C 3.45Å; I324-A349 VanDerWaalsContact O-CA 3.24Å; I324-A349 WeakPolarHBondContact O-CA 3.49Å; I324-W350 VanDerWaalsContact O-CD1 3.31Å; I324-W350 PolarHBondContact O-N 3.3Å
325	N	98.4	Very high	97.2	Very high	24 Å²	24	43.8 Å²	43.8	13%	0.128	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	156.3	170.3	71	38.3	0	0	0	111.4	N304 Q327 V328 M329 W350	N304-N325 PolarHBondContact OD1-N 2.56Å; N325-Q327 VanDerWaalsContact C-N 3.25Å; N325-Q327 PolarHBondContact O-N 2.96Å; N325-Q327 WeakPolarHBondContact OD1-CB 3.48Å; N325-Q327 PolarHBondContact OD1-N 2.85Å; N325-V328 PolarHBondContact O-N 3.41Å; N325-V328 VanDerWaalsContact O-N 3.15Å; N325-V328 VanDerWaalsContact OD1-CG2 3.26Å; N325-V328 WeakPolarHBondContact OD1-CG2 3.23Å; N325-V328 PolarHBondContact OD1-N 3.31Å; N325-M329 PolarHBondContact O-N 2.76Å; N325-W350 CarbonylContact C-O 3.56Å; N325-W350 WeakPolarHBondContact CA-O 3.48Å; N325-W350 HydrophobicContact CB-CZ2 3.99Å
326	S	98.4	Very high	97.2	Very high	2 Å²	2	44 Å²	44	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-29.6	-179.2	57.6	0	0	0	0	114.1	V328 M329 A330 W350 D351	S326-V328 PolarHBondContact O-N 3.22Å; S326-M329 PolarHBondContact O-N 2.81Å; S326-A330 WeakPolarHBondContact O-CB 3.34Å; S326-A330 PolarHBondContact O-N 3.19Å; S326-W350 PolarHBondContact N-O 3.01Å; S326-D351 WeakPolarHBondContact CB-OD1 3.39Å; S326-D351 PolarHBondContact OG-OD1 2.9Å
327	Q	97.8	Very high	97.1	Very high	97 Å²	97	45.9 Å²	45.9	45%	0.453	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-42.4	174.3	-175.7	-177.7	31.9	0	0	111.8	N325 M329 A330 S331 Y368	N325-Q327 VanDerWaalsContact C-N 3.25Å; N325-Q327 PolarHBondContact O-N 2.96Å; N325-Q327 WeakPolarHBondContact OD1-CB 3.48Å; N325-Q327 PolarHBondContact OD1-N 2.85Å; Q327-M329 VanDerWaalsContact C-N 3.3Å; Q327-M329 PolarHBondContact O-N 3.28Å; Q327-A330 PolarHBondContact O-N 2.9Å; Q327-S331 WeakPolarHBondContact O-CB 3.21Å; Q327-S331 PolarHBondContact O-N 2.94Å; Q327-Y368 HydrophobicContact CB-CD1 4.27Å; Q327-Y368 HydrophobicContact CB-CD2 3.85Å; Q327-Y368 HydrophobicContact CB-CE1 4.09Å; Q327-Y368 HydrophobicContact CB-CE2 3.64Å; Q327-Y368 HydrophobicContact CB-CG 4.16Å; Q327-Y368 HydrophobicContact CG-CD1 4.38Å; Q327-Y368 HydrophobicContact CG-CE1 3.8Å; Q327-Y368 HydrophobicContact CG-CE2 4Å; Q327-Y368 PolarHBondContact NE2-OH 2.8Å
328	V	97.4	Very high	96.9	Very high	7 Å²	7	47 Å²	47	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-37.1	178.2	167.9	0	0	0	0	111	N304 I324 N325 S326 A330 H334 Y342	N304-V328 HydrophobicContact CB-CG2 3.92Å; I324-V328 HydrophobicContact CG2-CB 3.82Å; I324-V328 HydrophobicContact CG2-CG1 3.65Å; N325-V328 PolarHBondContact O-N 3.41Å; N325-V328 VanDerWaalsContact O-N 3.15Å; N325-V328 VanDerWaalsContact OD1-CG2 3.26Å; N325-V328 WeakPolarHBondContact OD1-CG2 3.23Å; N325-V328 PolarHBondContact OD1-N 3.31Å; S326-V328 PolarHBondContact O-N 3.22Å; V328-A330 VanDerWaalsContact C-N 3.32Å; V328-H334 HydrophobicContact CG1-CB 4Å; V328-Y342 WeakPolarHBondContact CG1-OH 3.47Å
329	M	97.7	Very high	96.8	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.02	24%	0.243	C	C	.	.	H	α-helix	trans	-68.2	-33	175.1	-62.5	173.1	61.2	0	0	112.3	I324 N325 S326 Q327 F336 A349 I370 Q373 F386	I324-M329 HydrophobicContact CG2-CG 3.87Å; N325-M329 PolarHBondContact O-N 2.76Å; S326-M329 PolarHBondContact O-N 2.81Å; Q327-M329 VanDerWaalsContact C-N 3.3Å; Q327-M329 PolarHBondContact O-N 3.28Å; M329-F336 HydrophobicContact CB-CD1 3.94Å; M329-F336 HydrophobicContact CB-CE1 4.14Å; M329-F336 HydrophobicContact CB-CG 4.3Å; M329-F336 HydrophobicContact CE-CE1 3.78Å; M329-F336 HydrophobicContact CE-CZ 4.01Å; M329-F336 HydrophobicContact CG-CD1 4.05Å; M329-F336 HydrophobicContact CG-CD2 4.26Å; M329-F336 HydrophobicContact CG-CE1 3.89Å; M329-F336 HydrophobicContact CG-CE2 4.13Å; M329-F336 HydrophobicContact CG-CG 4.24Å; M329-F336 HydrophobicContact CG-CZ 3.95Å; M329-F336 HydrophobicContact SD-CZ 4.47Å; M329-A349 HydrophobicContact CE-CB 4.4Å; M329-A349 HydrophobicContact SD-CB 3.55Å; M329-A349 VanDerWaalsContact SD-CB 3.55Å; M329-I370 HydrophobicContact CE-CG1 4.24Å; M329-I370 HydrophobicContact SD-CG1 4.13Å; M329-Q373 HydrophobicContact CB-CB 3.99Å; M329-Q373 HydrophobicContact CB-CG 4.36Å; M329-Q373 HydrophobicContact CE-CB 3.87Å; M329-Q373 VanDerWaalsContact O-CD 3.32Å; M329-Q373 WeakPolarHBondContact O-CG 3.3Å; M329-F386 HydrophobicContact CE-CE1 4.2Å; M329-F386 HydrophobicContact CE-CZ 3.75Å; M329-F386 HydrophobicContact SD-CZ 4.13Å
330	A	96.6	Very high	96.7	Very high	27 Å²	27	48.7 Å²	48.7	22%	0.223	27%	0.267	C	S	.	.	H	α-helix	trans	-84.3	-22.2	-177.3	0	0	0	0	0	114.1	S326 Q327 V328 Y368 P369	S326-A330 WeakPolarHBondContact O-CB 3.34Å; S326-A330 PolarHBondContact O-N 3.19Å; Q327-A330 PolarHBondContact O-N 2.9Å; V328-A330 VanDerWaalsContact C-N 3.32Å; A330-Y368 HydrophobicContact CB-CD1 4Å; A330-P369 HydrophobicContact CB-CG 4.01Å
331	S	95.4	Very high	96.6	Very high	35 Å²	35	48.9 Å²	48.9	25%	0.245	27%	0.267	C	S	.	.			trans	-86.2	130.4	-176.9	175.2	0	0	0	0	112.6	Q327 D333 H334	Q327-S331 WeakPolarHBondContact O-CB 3.21Å; Q327-S331 PolarHBondContact O-N 2.94Å; S331-D333 VanDerWaalsContact C-N 3.28Å; S331-D333 PolarHBondContact O-N 2.98Å; S331-D333 PolarHBondContact OG-N 2.81Å; S331-H334 PolarHBondContact O-N 2.64Å
332	D	92.1	Very high	96.6	Very high	141 Å²	141	48.9 Å²	48.9	75%	0.754	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-66.3	-28.8	176.6	-69.7	-34.8	0	0	0	112.6	H334 R335	D332-H334 PolarHBondContact O-N 3.05Å; D332-H334 VanDerWaalsContact O-N 3.16Å; D332-R335 WeakPolarHBondContact O-CG 3.43Å; D332-R335 PolarHBondContact O-N 2.78Å
333	D	92.4	Very high	96.3	Very high	142 Å²	142	51.6 Å²	51.6	76%	0.759	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-60.1	-30.3	-179	-68.2	-26.8	0	0	0	112.4	S331	S331-D333 VanDerWaalsContact C-N 3.28Å; S331-D333 PolarHBondContact O-N 2.98Å; S331-D333 PolarHBondContact OG-N 2.81Å
334	H	93.6	Very high	96	Very high	62 Å²	62	54.7 Å²	54.7	29%	0.287	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-86	-10.3	179.8	-65.6	-52.9	0	0	0	113.3	V328 S331 D332 F336	V328-H334 HydrophobicContact CG1-CB 4Å; S331-H334 PolarHBondContact O-N 2.64Å; D332-H334 PolarHBondContact O-N 3.05Å; D332-H334 VanDerWaalsContact O-N 3.16Å; H334-F336 PolarHBondContact O-N 2.81Å; H334-F336 VanDerWaalsContact O-N 3.14Å
335	R	95.6	Very high	95.9	Very high	174 Å²	174	56.2 Å²	56.2	66%	0.657	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	42.7	179.1	-66.7	-177.3	-80.3	177.6	-4.7	111.9	D332 L337 S338 S339	D332-R335 WeakPolarHBondContact O-CG 3.43Å; D332-R335 PolarHBondContact O-N 2.78Å; R335-L337 PolarHBondContact O-N 2.97Å; R335-L337 VanDerWaalsContact O-N 3.12Å; R335-S338 PolarHBondContact O-N 2.72Å; R335-S339 VanDerWaalsContact O-CB 3.26Å; R335-S339 WeakPolarHBondContact O-CB 3.38Å; R335-S339 PolarHBondContact O-N 3.48Å
336	F	97.3	Very high	95.9	Very high	5 Å²	5	55.8 Å²	55.8	2%	0.022	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-41	-170.4	171.1	-114.4	0	0	0	113.5	I324 M329 H334 Y342 L347 Y377 F386	I324-F336 HydrophobicContact CD1-CD2 4.42Å; I324-F336 HydrophobicContact CD1-CE2 3.82Å; M329-F336 HydrophobicContact CB-CD1 3.94Å; M329-F336 HydrophobicContact CB-CE1 4.14Å; M329-F336 HydrophobicContact CB-CG 4.3Å; M329-F336 HydrophobicContact CE-CE1 3.78Å; M329-F336 HydrophobicContact CE-CZ 4.01Å; M329-F336 HydrophobicContact CG-CD1 4.05Å; M329-F336 HydrophobicContact CG-CD2 4.26Å; M329-F336 HydrophobicContact CG-CE1 3.89Å; M329-F336 HydrophobicContact CG-CE2 4.13Å; M329-F336 HydrophobicContact CG-CG 4.24Å; M329-F336 HydrophobicContact CG-CZ 3.95Å; M329-F336 HydrophobicContact SD-CZ 4.47Å; H334-F336 PolarHBondContact O-N 2.81Å; H334-F336 VanDerWaalsContact O-N 3.14Å; F336-Y342 HydrophobicContact CB-CE2 4.43Å; F336-Y342 HydrophobicContact CD2-CD1 4.06Å; F336-Y342 AromaticContact CD2-CD2 3.88Å; F336-Y342 HydrophobicContact CD2-CD2 3.88Å; F336-Y342 HydrophobicContact CD2-CE1 4.25Å; F336-Y342 HydrophobicContact CD2-CE2 4.11Å; F336-Y342 AromaticContact CD2-CG 3.86Å; F336-Y342 HydrophobicContact CD2-CG 3.86Å; F336-Y342 HydrophobicContact CE2-CD1 4.24Å; F336-Y342 HydrophobicContact CE2-CG 4.16Å; F336-Y342 WeakPolarHBondContact O-CD2 3.49Å; F336-L347 HydrophobicContact CE2-CD1 4.33Å; F336-Y377 HydrophobicContact CD1-CD2 4.29Å; F336-Y377 AromaticContact CE1-CD2 3.62Å; F336-Y377 HydrophobicContact CE1-CD2 3.62Å; F336-Y377 AromaticContact CE1-CG 3.94Å; F336-Y377 HydrophobicContact CE1-CG 3.94Å; F336-Y377 HydrophobicContact CE2-CD2 4.03Å; F336-Y377 HydrophobicContact CE2-CE2 4.17Å; F336-Y377 AromaticContact CZ-CD2 3.45Å; F336-Y377 HydrophobicContact CZ-CD2 3.45Å; F336-Y377 VanDerWaalsContact CZ-CD2 3.45Å; F336-Y377 HydrophobicContact CZ-CE2 4.03Å; F336-Y377 AromaticContact CZ-CG 3.77Å; F336-Y377 HydrophobicContact CZ-CG 3.77Å; F336-F386 HydrophobicContact CE1-CE1 4.46Å; F336-F386 AromaticContact CZ-CE1 3.76Å; F336-F386 HydrophobicContact CZ-CE1 3.76Å; F336-F386 AromaticContact CZ-CZ 3.79Å; F336-F386 HydrophobicContact CZ-CZ 3.79Å
337	L	96.6	Very high	95.9	Very high	38 Å²	38	55.7 Å²	55.7	20%	0.199	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-15.9	-178	-60.7	177.8	0	0	0	114.8	R335 R376 Y377 L380	R335-L337 PolarHBondContact O-N 2.97Å; R335-L337 VanDerWaalsContact O-N 3.12Å; L337-R376 HydrophobicContact CD1-CB 4.17Å; L337-R376 HydrophobicContact CD2-CB 4Å; L337-Y377 HydrophobicContact CD2-CD2 4.15Å; L337-L380 HydrophobicContact CB-CD1 4.31Å
338	S	95.8	Very high	96	Very high	98 Å²	98	51 Å²	51	69%	0.685	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-15.7	-172.3	59.4	0	0	0	0	114.6	R335	R335-S338 PolarHBondContact O-N 2.72Å
339	S	96.6	Very high	96	Very high	36 Å²	36	50.7 Å²	50.7	25%	0.252	30%	0.298	S	S	.	.			trans	-75.1	129.2	179.2	179.6	0	0	0	0	111.5	R335 L341 Y342	R335-S339 VanDerWaalsContact O-CB 3.26Å; R335-S339 WeakPolarHBondContact O-CB 3.38Å; R335-S339 PolarHBondContact O-N 3.48Å; S339-L341 PolarHBondContact O-N 3.33Å; S339-L341 VanDerWaalsContact O-N 3.11Å; S339-L341 WeakPolarHBondContact OG-CB 3.34Å; S339-L341 PolarHBondContact OG-N 3.15Å; S339-Y342 PolarHBondContact O-N 2.87Å
340	S	95.8	Very high	96.1	Very high	97 Å²	97	50.7 Å²	50.7	68%	0.678	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-62.7	-14.8	173.5	55.7	0	0	0	0	113.6	Y342 S343	S340-Y342 PolarHBondContact O-N 2.93Å; S340-S343 PolarHBondContact O-N 2.79Å; S340-S343 PolarHBondContact O-OG 3.44Å
341	L	96.6	Very high	96.2	Very high	34 Å²	34	49.5 Å²	49.5	18%	0.178	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-56.8	-32.2	174.6	-177.7	65.3	0	0	0	112.6	A305 P307 S339	A305-L341 HydrophobicContact CB-CD2 4.33Å; A305-L341 WeakPolarHBondContact O-CD2 3.43Å; P307-L341 HydrophobicContact CB-CD1 4.38Å; S339-L341 PolarHBondContact O-N 3.33Å; S339-L341 VanDerWaalsContact O-N 3.11Å; S339-L341 WeakPolarHBondContact OG-CB 3.34Å; S339-L341 PolarHBondContact OG-N 3.15Å
342	Y	97.6	Very high	96.2	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-96	-12.1	-176.1	-56.5	-68.3	0	0	0	112.8	N304 A305 I324 V328 F336 S339 S340 S344 Y377 Q384	N304-Y342 WeakPolarHBondContact O-CE1 3.46Å; A305-Y342 WeakPolarHBondContact CB-OH 3.41Å; I324-Y342 HydrophobicContact CD1-CD1 3.51Å; I324-Y342 HydrophobicContact CD1-CE1 3.73Å; I324-Y342 HydrophobicContact CG1-CE1 4.38Å; V328-Y342 WeakPolarHBondContact CG1-OH 3.47Å; F336-Y342 HydrophobicContact CB-CE2 4.43Å; F336-Y342 HydrophobicContact CD2-CD1 4.06Å; F336-Y342 AromaticContact CD2-CD2 3.88Å; F336-Y342 HydrophobicContact CD2-CD2 3.88Å; F336-Y342 HydrophobicContact CD2-CE1 4.25Å; F336-Y342 HydrophobicContact CD2-CE2 4.11Å; F336-Y342 AromaticContact CD2-CG 3.86Å; F336-Y342 HydrophobicContact CD2-CG 3.86Å; F336-Y342 HydrophobicContact CE2-CD1 4.24Å; F336-Y342 HydrophobicContact CE2-CG 4.16Å; F336-Y342 WeakPolarHBondContact O-CD2 3.49Å; S339-Y342 PolarHBondContact O-N 2.87Å; S340-Y342 PolarHBondContact O-N 2.93Å; Y342-S344 PolarHBondContact O-N 2.82Å; Y342-S344 VanDerWaalsContact O-N 3.15Å; Y342-Y377 PolarHBondContact O-OH 3.11Å; Y342-Q384 PolarHBondContact O-NE2 3.27Å; Y342-Q384 PolarHBondContact O-OE1 2.92Å
343	S	94.1	Very high	96.3	Very high	59 Å²	59	41.6 Å²	41.6	41%	0.413	24%	0.243	S	C	.	.	S	Bend	trans	-81.8	12.6	-169.4	68.9	0	0	0	0	115.1	S340	S340-S343 PolarHBondContact O-N 2.79Å; S340-S343 PolarHBondContact O-OG 3.44Å
344	S	92	Very high	96.4	Very high	66 Å²	66	37 Å²	37	46%	0.462	22%	0.221	S	C	.	.	S	Bend	trans	-141.7	156.8	-178.9	65	0	0	0	0	112	Y342 Q384	Y342-S344 PolarHBondContact O-N 2.82Å; Y342-S344 VanDerWaalsContact O-N 3.15Å; S344-Q384 PolarHBondContact O-NE2 2.85Å
345	G	96.3	Very high	96.1	Very high	32 Å²	32	34.7 Å²	34.7	33%	0.33	21%	0.21	S	C	.	.	S	Bend	trans	67.8	-170.4	-175.2	0	0	0	0	0	112.7	Q384	G345-Q384 VanDerWaalsContact O-CG 3.3Å; G345-Q384 WeakPolarHBondContact O-CG 3.45Å; G345-Q384 PolarHBondContact O-NE2 3.2Å
346	V	98.5	Very high	95.4	Very high	14 Å²	14	32.7 Å²	32.7	9%	0.085	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	132.3	176.7	179.6	0	0	0	0	109.6	L270 T320 V321 R322 V348 P385 Y387	L270-V346 HydrophobicContact CD1-CB 4.37Å; L270-V346 HydrophobicContact CD1-CG1 4.1Å; L270-V346 HydrophobicContact CD1-CG2 4.22Å; L270-V346 HydrophobicContact CD2-CG2 3.81Å; T320-V346 PolarHBondContact O-N 3.18Å; V321-V346 CarbonylContact C-O 3.56Å; V321-V346 WeakPolarHBondContact CA-O 3.24Å; V321-V346 HydrophobicContact CG2-CB 4.5Å; R322-V346 PolarHBondContact N-O 3.06Å; V346-V348 HydrophobicContact CG1-CG2 4.38Å; V346-P385 HydrophobicContact CG1-CB 4.12Å; V346-P385 HydrophobicContact CG2-CB 4.15Å; V346-P385 HydrophobicContact CG2-CG 4.36Å; V346-Y387 HydrophobicContact CG1-CD2 3.75Å; V346-Y387 HydrophobicContact CG1-CE2 3.7Å
347	L	98.8	Very high	94.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	143.8	171.5	-60.2	-170.3	0	0	0	110.7	R322 I324 F336 Y377 P385 F386 Y387	R322-L347 HydrophobicContact CB-CD2 3.88Å; R322-L347 HydrophobicContact CG-CD2 4.45Å; I324-L347 HydrophobicContact CD1-CD1 4.3Å; I324-L347 HydrophobicContact CD1-CD2 3.98Å; F336-L347 HydrophobicContact CE2-CD1 4.33Å; L347-Y377 HydrophobicContact CD1-CD1 4.32Å; L347-Y377 HydrophobicContact CD1-CE1 3.58Å; L347-Y377 HydrophobicContact CD1-CE2 4.2Å; L347-P385 PolarHBondContact N-O 3.25Å; L347-F386 HydrophobicContact CB-CB 4.08Å; L347-F386 HydrophobicContact CB-CD1 4.44Å; L347-F386 HydrophobicContact CB-CD2 3.25Å; L347-F386 HydrophobicContact CB-CE2 3.61Å; L347-F386 HydrophobicContact CB-CG 3.7Å; L347-F386 HydrophobicContact CB-CZ 4.35Å; L347-F386 HydrophobicContact CD1-CD1 4.33Å; L347-F386 HydrophobicContact CD1-CD2 4.45Å; L347-F386 HydrophobicContact CD1-CE1 4.36Å; L347-F386 HydrophobicContact CD1-CE2 4.45Å; L347-F386 HydrophobicContact CD1-CG 4.36Å; L347-F386 HydrophobicContact CD1-CZ 4.4Å; L347-F386 HydrophobicContact CG-CD2 4.47Å; L347-F386 VanDerWaalsContact O-CA 3.3Å; L347-F386 WeakPolarHBondContact O-CA 3.48Å; L347-F386 WeakPolarHBondContact O-CD2 3.31Å; L347-Y387 PolarHBondContact O-N 3.02Å
348	V	98.8	Very high	94.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	121.7	172.9	-174.3	0	0	0	0	107.4	L266 V321 R322 L323 I324 V346 Y387 L389 L423	L266-V348 HydrophobicContact CD1-CG1 4.41Å; L266-V348 HydrophobicContact CD1-CG2 3.39Å; V321-V348 HydrophobicContact CG1-CG2 3.77Å; R322-V348 PolarHBondContact O-N 3.41Å; L323-V348 CarbonylContact C-O 3.52Å; L323-V348 WeakPolarHBondContact CA-O 2.98Å; L323-V348 HydrophobicContact CD1-CB 3.89Å; L323-V348 HydrophobicContact CD1-CG1 3.67Å; L323-V348 WeakPolarHBondContact CD1-O 3.36Å; I324-V348 PolarHBondContact N-O 3.4Å; V346-V348 HydrophobicContact CG1-CG2 4.38Å; V348-Y387 CarbonylContact C-O 3.53Å; V348-Y387 WeakPolarHBondContact CA-O 3.24Å; V348-L389 HydrophobicContact CG1-CD1 4.11Å; V348-L389 HydrophobicContact CG1-CD2 3.83Å; V348-L389 HydrophobicContact CG1-CG 3.56Å; V348-L423 HydrophobicContact CG1-CD2 4.45Å; V348-L423 HydrophobicContact CG2-CD2 4.42Å
349	A	98.7	Very high	94.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	153.5	177	0	0	0	0	0	111.6	I324 M329 I370 F386 Y387 I388 L389	I324-A349 CarbonylContact O-C 3.45Å; I324-A349 VanDerWaalsContact O-CA 3.24Å; I324-A349 WeakPolarHBondContact O-CA 3.49Å; M329-A349 HydrophobicContact CE-CB 4.4Å; M329-A349 HydrophobicContact SD-CB 3.55Å; M329-A349 VanDerWaalsContact SD-CB 3.55Å; A349-I370 HydrophobicContact CB-CD1 3.83Å; A349-I370 HydrophobicContact CB-CG1 4.35Å; A349-F386 HydrophobicContact CB-CE2 3.59Å; A349-F386 HydrophobicContact CB-CZ 3.95Å; A349-Y387 PolarHBondContact N-O 3.15Å; A349-I388 HydrophobicContact CB-CG1 4.42Å; A349-I388 CarbonylContact O-C 3.54Å; A349-I388 WeakPolarHBondContact O-CA 3.42Å; A349-L389 PolarHBondContact O-N 3.14Å
350	W	98.7	Very high	94.1	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.015	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	151.8	171	74.5	-76.3	0	0	0	111	L323 I324 N325 S326 P352 L389 E394 P413 S416 L419	L323-W350 HydrophobicContact CD1-CG 4.47Å; I324-W350 VanDerWaalsContact O-CD1 3.31Å; I324-W350 PolarHBondContact O-N 3.3Å; N325-W350 CarbonylContact C-O 3.56Å; N325-W350 WeakPolarHBondContact CA-O 3.48Å; N325-W350 HydrophobicContact CB-CZ2 3.99Å; S326-W350 PolarHBondContact N-O 3.01Å; W350-P352 HydrophobicContact CH2-CG 4.47Å; W350-P352 HydrophobicContact CZ3-CG 3.99Å; W350-L389 HydrophobicContact CB-CB 4.14Å; W350-L389 HydrophobicContact CB-CD1 4.08Å; W350-L389 HydrophobicContact CB-CG 4.48Å; W350-E394 HydrophobicContact CE3-CG 4.11Å; W350-E394 HydrophobicContact CZ3-CG 4.3Å; W350-E394 WeakPolarHBondContact CZ3-OE2 3.46Å; W350-P413 HydrophobicContact CH2-CG 4.24Å; W350-P413 HydrophobicContact CZ3-CB 4.08Å; W350-P413 HydrophobicContact CZ3-CG 3.98Å; W350-S416 VanDerWaalsContact CZ2-OG 3.22Å; W350-S416 WeakPolarHBondContact CZ2-OG 3.43Å; W350-S416 PolarHBondContact NE1-OG 2.86Å; W350-L419 HydrophobicContact CD2-CD1 3.64Å; W350-L419 HydrophobicContact CE3-CD1 3.68Å; W350-L419 HydrophobicContact CG-CD1 4.25Å; W350-L419 HydrophobicContact CH2-CD1 4.02Å; W350-L419 HydrophobicContact CZ2-CD1 4.02Å; W350-L419 HydrophobicContact CZ3-CD1 3.86Å
351	D	98.4	Very high	94	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	19%	0.192	C	C	.	.			trans	-141.6	131.1	-179.5	178.7	71.4	0	0	0	109.6	S326 A353 W362 T366 D367 Y368 I370 E394	S326-D351 WeakPolarHBondContact CB-OD1 3.39Å; S326-D351 PolarHBondContact OG-OD1 2.9Å; D351-A353 PolarHBondContact O-N 3.23Å; D351-A353 VanDerWaalsContact O-N 3.15Å; D351-W362 HydrophobicContact CB-CZ2 3.94Å; D351-W362 PolarHBondContact OD2-NE1 2.92Å; D351-T366 WeakPolarHBondContact OD2-CA 3.39Å; D351-T366 WeakPolarHBondContact OD2-CB 3.45Å; D351-D367 WeakPolarHBondContact OD1-CB 3.21Å; D351-D367 PolarHBondContact OD1-N 3.29Å; D351-D367 PolarHBondContact OD2-N 2.64Å; D351-Y368 PolarHBondContact OD1-N 3.08Å; D351-I370 HydrophobicContact CB-CB 4.2Å; D351-I370 HydrophobicContact CB-CD1 3.8Å; D351-I370 HydrophobicContact CB-CG2 3.98Å; D351-E394 VanDerWaalsContact O-OE1 3.11Å
352	P	96.8	Very high	94	Very high	10 Å²	10	31.5 Å²	31.5	7%	0.065	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-55.6	117.3	177	-27.8	36.3	0	0	0	113.3	Y210 W350 D367 E394 P413	Y210-P352 HydrophobicContact CD1-CB 4.33Å; Y210-P352 HydrophobicContact CE1-CB 3.47Å; Y210-P352 VanDerWaalsContact CE1-CB 3.47Å; W350-P352 HydrophobicContact CH2-CG 4.47Å; W350-P352 HydrophobicContact CZ3-CG 3.99Å; P352-D367 HydrophobicContact CB-CB 4.19Å; P352-D367 HydrophobicContact CG-CB 4.4Å; P352-E394 WeakPolarHBondContact CA-OE2 3.4Å; P352-P413 HydrophobicContact CB-CG 3.99Å; P352-P413 HydrophobicContact CG-CG 3.96Å
353	A	94.4	Very high	93.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-96.3	159.3	172.7	0	0	0	0	0	112	D351 W362 P391 W395	D351-A353 PolarHBondContact O-N 3.23Å; D351-A353 VanDerWaalsContact O-N 3.15Å; A353-W362 HydrophobicContact CB-CB 4.04Å; A353-W362 VanDerWaalsContact CB-CD1 3.42Å; A353-W362 HydrophobicContact CB-CD2 4.35Å; A353-W362 HydrophobicContact CB-CG 3.66Å; A353-P391 HydrophobicContact CB-CB 3.39Å; A353-P391 HydrophobicContact CB-CG 4.06Å; A353-W395 VanDerWaalsContact O-CE2 3.25Å; A353-W395 WeakPolarHBondContact O-CZ2 3.43Å; A353-W395 PolarHBondContact O-NE1 2.82Å
354	P	92.7	Very high	93.9	Very high	46 Å²	46	36.4 Å²	36.4	30%	0.299	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-58.7	147	166.9	-19	29.1	0	0	0	112.3	F356 S357	P354-F356 PolarHBondContact O-N 3.42Å; P354-S357 WeakPolarHBondContact CD-OG 3.43Å; P354-S357 WeakPolarHBondContact O-CB 3.34Å; P354-S357 PolarHBondContact O-N 3.24Å; P354-S357 VanDerWaalsContact O-N 3.1Å; P354-S357 PolarHBondContact O-OG 2.86Å
355	F	89.3	Confident	93.8	Very high	14 Å²	14	39.8 Å²	39.8	6%	0.061	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-43	-168.9	-176.2	-123.5	0	0	0	114.9	Y210 V212 K213 W395 W398 Q399	Y210-F355 WeakPolarHBondContact O-CB 3.4Å; Y210-F355 PolarHBondContact O-N 3.04Å; V212-F355 HydrophobicContact CB-CD1 4.48Å; V212-F355 HydrophobicContact CB-CG 4.3Å; V212-F355 HydrophobicContact CG1-CD1 4.37Å; V212-F355 HydrophobicContact CG1-CD2 4.29Å; V212-F355 HydrophobicContact CG1-CE1 4.3Å; V212-F355 HydrophobicContact CG1-CE2 4.23Å; V212-F355 HydrophobicContact CG1-CG 4.37Å; V212-F355 HydrophobicContact CG1-CZ 4.23Å; V212-F355 HydrophobicContact CG2-CB 4.13Å; V212-F355 HydrophobicContact CG2-CD2 4.17Å; V212-F355 HydrophobicContact CG2-CG 4.17Å; K213-F355 HydrophobicContact CB-CE1 4.46Å; K213-F355 WeakPolarHBondContact O-CE1 3.29Å; F355-W395 HydrophobicContact CB-CD2 4.46Å; F355-W395 HydrophobicContact CD2-CB 3.83Å; F355-W395 AromaticContact CD2-CD2 3.5Å; F355-W395 HydrophobicContact CD2-CD2 3.5Å; F355-W395 AromaticContact CD2-CE3 3.42Å; F355-W395 HydrophobicContact CD2-CE3 3.42Å; F355-W395 VanDerWaalsContact CD2-CE3 3.42Å; F355-W395 AromaticContact CD2-CG 3.68Å; F355-W395 HydrophobicContact CD2-CG 3.68Å; F355-W395 HydrophobicContact CD2-CZ3 4.13Å; F355-W395 HydrophobicContact CE2-CB 3.97Å; F355-W395 HydrophobicContact CE2-CD2 4.25Å; F355-W395 AromaticContact CE2-CE3 3.92Å; F355-W395 HydrophobicContact CE2-CE3 3.92Å; F355-W395 HydrophobicContact CE2-CG 4.3Å; F355-W395 HydrophobicContact CG-CD2 4.46Å; F355-W398 HydrophobicContact CE2-CE3 4.03Å; F355-W398 HydrophobicContact CE2-CZ3 4.43Å; F355-W398 HydrophobicContact CZ-CE3 4.43Å; F355-W398 HydrophobicContact CZ-CZ3 4.43Å; F355-Q399 HydrophobicContact CE2-CG 4.16Å; F355-Q399 HydrophobicContact CZ-CG 4.04Å
356	F	80.1	Confident	93.8	Very high	131 Å²	131	40.3 Å²	40.3	58%	0.575	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.7	47	176	-69.8	-65.9	0	0	0	111.4	K213 P354	K213-F356 HydrophobicContact CB-CE2 4.02Å; K213-F356 HydrophobicContact CD-CD2 4.34Å; K213-F356 HydrophobicContact CD-CE2 3.96Å; K213-F356 HydrophobicContact CG-CD2 4.46Å; K213-F356 HydrophobicContact CG-CE2 4.03Å; P354-F356 PolarHBondContact O-N 3.42Å
357	S	79.7	Confident	93.7	Very high	27 Å²	27	41.8 Å²	41.8	19%	0.189	21%	0.213	C	C	.	.			trans	-91.9	137.5	174.9	57.7	0	0	0	0	112	P354	P354-S357 WeakPolarHBondContact CD-OG 3.43Å; P354-S357 WeakPolarHBondContact O-CB 3.34Å; P354-S357 PolarHBondContact O-N 3.24Å; P354-S357 VanDerWaalsContact O-N 3.1Å; P354-S357 PolarHBondContact O-OG 2.86Å
358	N	90.1	Very high	93.6	Very high	88 Å²	88	45.7 Å²	45.7	47%	0.471	23%	0.229	S	C	.	.			trans	-77.7	165.7	157.7	67.9	28.5	0	0	0	109.6	T360 Q361 W362	N358-T360 PolarHBondContact O-N 3.05Å; N358-T360 WeakPolarHBondContact OD1-CB 3.26Å; N358-T360 PolarHBondContact OD1-N 3.15Å; N358-Q361 PolarHBondContact O-N 3.36Å; N358-Q361 VanDerWaalsContact O-N 3.12Å; N358-Q361 WeakPolarHBondContact OD1-CG 3.5Å; N358-Q361 PolarHBondContact OD1-N 3.41Å; N358-W362 PolarHBondContact O-N 2.89Å; N358-W362 VanDerWaalsContact O-N 3.08Å
359	L	95.1	Very high	93.5	Very high	16 Å²	16	48.8 Å²	48.8	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-58.1	-31.5	-178.2	-72.4	178.3	0	0	0	113.2	L244 H248 Q249 F251 W362 Y363 P391	L244-L359 HydrophobicContact CD2-CD1 4.17Å; L244-L359 HydrophobicContact CD2-CD2 3.75Å; H248-L359 HydrophobicContact CB-CD1 3.67Å; Q249-L359 WeakPolarHBondContact O-CB 3.27Å; F251-L359 HydrophobicContact CE2-CB 4.34Å; F251-L359 HydrophobicContact CE2-CD1 4.29Å; L359-W362 HydrophobicContact CD2-CE3 3.69Å; L359-W362 HydrophobicContact CD2-CZ3 3.83Å; L359-Y363 WeakPolarHBondContact O-CB 3.26Å; L359-Y363 PolarHBondContact O-N 3Å; L359-P391 HydrophobicContact CD2-CG 3.88Å
360	T	94.7	Very high	93.5	Very high	55 Å²	55	48.8 Å²	48.8	34%	0.337	25%	0.249	S	C	.	.	H	α-helix	trans	-66.6	-44.3	176.7	-53.5	0	0	0	0	111.9	P250 N358 Y363 N364	P250-T360 HydrophobicContact CB-CG2 4.5Å; N358-T360 PolarHBondContact O-N 3.05Å; N358-T360 WeakPolarHBondContact OD1-CB 3.26Å; N358-T360 PolarHBondContact OD1-N 3.15Å; T360-Y363 PolarHBondContact O-N 3.47Å; T360-N364 PolarHBondContact O-N 3.23Å; T360-N364 VanDerWaalsContact O-N 3.17Å; T360-N364 PolarHBondContact O-ND2 2.81Å
361	Q	93.4	Very high	93.5	Very high	97 Å²	97	49.1 Å²	49.1	45%	0.453	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-44	177.4	-73.8	174.1	-5.9	0	0	111.4	N358 N364 H365	N358-Q361 PolarHBondContact O-N 3.36Å; N358-Q361 VanDerWaalsContact O-N 3.12Å; N358-Q361 WeakPolarHBondContact OD1-CG 3.5Å; N358-Q361 PolarHBondContact OD1-N 3.41Å; Q361-N364 PolarHBondContact O-N 3.44Å; Q361-H365 PolarHBondContact O-N 3.45Å; Q361-H365 VanDerWaalsContact O-N 3.12Å; Q361-H365 PolarHBondContact O-ND1 3.12Å
362	W	95.8	Very high	93.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-43.8	175.9	171	54.5	0	0	0	112.1	L244 F251 D351 A353 N358 L359 N364 H365 T366 F371 I388 P391	L244-W362 HydrophobicContact CD1-CH2 3.86Å; L244-W362 HydrophobicContact CD1-CZ3 3.67Å; L244-W362 HydrophobicContact CD2-CZ3 4.06Å; L244-W362 HydrophobicContact CG-CZ3 4.35Å; F251-W362 HydrophobicContact CZ-CZ3 4.42Å; D351-W362 HydrophobicContact CB-CZ2 3.94Å; D351-W362 PolarHBondContact OD2-NE1 2.92Å; A353-W362 HydrophobicContact CB-CB 4.04Å; A353-W362 VanDerWaalsContact CB-CD1 3.42Å; A353-W362 HydrophobicContact CB-CD2 4.35Å; A353-W362 HydrophobicContact CB-CG 3.66Å; N358-W362 PolarHBondContact O-N 2.89Å; N358-W362 VanDerWaalsContact O-N 3.08Å; L359-W362 HydrophobicContact CD2-CE3 3.69Å; L359-W362 HydrophobicContact CD2-CZ3 3.83Å; W362-N364 PolarHBondContact O-N 2.91Å; W362-H365 CarbonylContact O-C 3.5Å; W362-H365 PolarHBondContact O-N 2.69Å; W362-T366 WeakPolarHBondContact O-CG2 3.48Å; W362-T366 PolarHBondContact O-N 3.38Å; W362-T366 VanDerWaalsContact O-N 3.08Å; W362-F371 HydrophobicContact CD2-CZ 4.48Å; W362-F371 HydrophobicContact CE3-CZ 4.1Å; W362-F371 HydrophobicContact CH2-CE1 4.32Å; W362-F371 AromaticContact CH2-CZ 3.73Å; W362-F371 HydrophobicContact CH2-CZ 3.73Å; W362-F371 HydrophobicContact CZ2-CZ 4.08Å; W362-F371 HydrophobicContact CZ3-CE1 4.44Å; W362-F371 AromaticContact CZ3-CZ 3.72Å; W362-F371 HydrophobicContact CZ3-CZ 3.72Å; W362-I388 HydrophobicContact CH2-CG2 3.88Å; W362-P391 HydrophobicContact CD2-CB 4.46Å; W362-P391 HydrophobicContact CD2-CG 3.95Å; W362-P391 HydrophobicContact CE3-CG 3.75Å; W362-P391 HydrophobicContact CG-CG 4.45Å; W362-P391 HydrophobicContact CH2-CG 4.46Å; W362-P391 HydrophobicContact CZ3-CG 4.02Å
363	Y	95.8	Very high	93.5	Very high	60 Å²	60	54 Å²	54	24%	0.235	28%	0.275	C	S	.	.	H	α-helix	trans	-55.2	-38	176.4	-178	-95.2	0	0	0	112.5	P250 F251 L254 W256 L359 T360 F371	P250-Y363 HydrophobicContact CG-CD1 4.13Å; P250-Y363 HydrophobicContact CG-CD2 4.44Å; P250-Y363 HydrophobicContact CG-CG 3.86Å; F251-Y363 AromaticContact CE1-CD2 3.68Å; F251-Y363 HydrophobicContact CE1-CD2 3.68Å; F251-Y363 HydrophobicContact CE1-CE2 4.03Å; F251-Y363 AromaticContact CZ-CD2 3.94Å; F251-Y363 HydrophobicContact CZ-CD2 3.94Å; L254-Y363 HydrophobicContact CD1-CD2 4.25Å; L254-Y363 HydrophobicContact CD1-CE1 4.07Å; L254-Y363 HydrophobicContact CD1-CE2 3.58Å; L254-Y363 VanDerWaalsContact CD1-CZ 3.47Å; W256-Y363 HydrophobicContact CZ2-CE2 4.09Å; L359-Y363 WeakPolarHBondContact O-CB 3.26Å; L359-Y363 PolarHBondContact O-N 3Å; T360-Y363 PolarHBondContact O-N 3.47Å; Y363-F371 HydrophobicContact CD2-CD1 4.4Å; Y363-F371 AromaticContact CD2-CD2 3.56Å; Y363-F371 HydrophobicContact CD2-CD2 3.56Å; Y363-F371 HydrophobicContact CD2-CE1 4.3Å; Y363-F371 AromaticContact CD2-CE2 3.45Å; Y363-F371 HydrophobicContact CD2-CE2 3.45Å; Y363-F371 VanDerWaalsContact CD2-CE2 3.45Å; Y363-F371 HydrophobicContact CD2-CG 4.07Å; Y363-F371 AromaticContact CD2-CZ 3.84Å; Y363-F371 HydrophobicContact CD2-CZ 3.84Å; Y363-F371 HydrophobicContact CE2-CB 4.38Å; Y363-F371 HydrophobicContact CE2-CD1 4.33Å; Y363-F371 AromaticContact CE2-CD2 3.7Å; Y363-F371 HydrophobicContact CE2-CD2 3.7Å; Y363-F371 HydrophobicContact CE2-CE2 4.08Å; Y363-F371 AromaticContact CE2-CG 3.86Å; Y363-F371 HydrophobicContact CE2-CG 3.86Å; Y363-F371 HydrophobicContact CG-CE2 4.25Å
364	N	93.5	Very high	93.7	Very high	104 Å²	104	54 Å²	54	56%	0.556	28%	0.275	S	S	*	.	H	α-helix	trans	-79.6	-19.5	178.1	-69.4	-19.7	0	0	0	113.8	T360 Q361 W362	T360-N364 PolarHBondContact O-N 3.23Å; T360-N364 VanDerWaalsContact O-N 3.17Å; T360-N364 PolarHBondContact O-ND2 2.81Å; Q361-N364 PolarHBondContact O-N 3.44Å; W362-N364 PolarHBondContact O-N 2.91Å
365	H	91.1	Very high	93.9	Very high	137 Å²	137	53.4 Å²	53.4	63%	0.634	27%	0.268	S	S	*	.	S	Bend	trans	-140.3	60.6	-173.5	-58.8	88.7	0	0	0	111.1	Q361 W362	Q361-H365 PolarHBondContact O-N 3.45Å; Q361-H365 VanDerWaalsContact O-N 3.12Å; Q361-H365 PolarHBondContact O-ND1 3.12Å; W362-H365 CarbonylContact O-C 3.5Å; W362-H365 PolarHBondContact O-N 2.69Å
366	T	95.9	Very high	94.3	Very high	42 Å²	42	58.4 Å²	58.4	26%	0.258	29%	0.287	S	S	.	.			trans	-70	147.6	172.7	56.7	0	0	0	0	110.9	D351 W362 Y368 I370 F371	D351-T366 WeakPolarHBondContact OD2-CA 3.39Å; D351-T366 WeakPolarHBondContact OD2-CB 3.45Å; W362-T366 WeakPolarHBondContact O-CG2 3.48Å; W362-T366 PolarHBondContact O-N 3.38Å; W362-T366 VanDerWaalsContact O-N 3.08Å; T366-Y368 VanDerWaalsContact C-N 3.35Å; T366-Y368 WeakPolarHBondContact CB-O 3.45Å; T366-Y368 PolarHBondContact OG1-O 3.02Å; T366-Y368 VanDerWaalsContact OG1-O 3.06Å; T366-I370 HydrophobicContact CG2-CG2 3.96Å; T366-F371 HydrophobicContact CG2-CD2 3.75Å; T366-F371 HydrophobicContact CG2-CE2 3.43Å; T366-F371 VanDerWaalsContact CG2-CE2 3.43Å
367	D	95.7	Very high	95.2	Very high	46 Å²	46	52.2 Å²	52.2	25%	0.246	26%	0.26	C	S	.	.	S	Bend	trans	-69.9	-36.9	177.1	-156	16.4	0	0	0	111.5	K209 Y210 D351 P352	K209-D367 WeakPolarHBondContact CE-OD1 3.44Å; K209-D367 IonicContact NZ-OD1 2.94Å; K209-D367 PolarHBondContact NZ-OD1 3.47Å; K209-D367 IonicContact NZ-OD2 3.21Å; K209-D367 PolarHBondContact NZ-OD2 2.87Å; Y210-D367 PolarHBondContact OH-OD2 3.34Å; D351-D367 WeakPolarHBondContact OD1-CB 3.21Å; D351-D367 PolarHBondContact OD1-N 3.29Å; D351-D367 PolarHBondContact OD2-N 2.64Å; P352-D367 HydrophobicContact CB-CB 4.19Å; P352-D367 HydrophobicContact CG-CB 4.4Å
368	Y	97.5	Very high	96.1	Very high	81 Å²	81	52.4 Å²	52.4	32%	0.318	26%	0.256	S	S	.	.	S	Bend	trans	-132.9	159.4	169.9	-70.4	-87.5	0	0	0	110.4	Q327 A330 D351 T366 I370	Q327-Y368 HydrophobicContact CB-CD1 4.27Å; Q327-Y368 HydrophobicContact CB-CD2 3.85Å; Q327-Y368 HydrophobicContact CB-CE1 4.09Å; Q327-Y368 HydrophobicContact CB-CE2 3.64Å; Q327-Y368 HydrophobicContact CB-CG 4.16Å; Q327-Y368 HydrophobicContact CG-CD1 4.38Å; Q327-Y368 HydrophobicContact CG-CE1 3.8Å; Q327-Y368 HydrophobicContact CG-CE2 4Å; Q327-Y368 PolarHBondContact NE2-OH 2.8Å; A330-Y368 HydrophobicContact CB-CD1 4Å; D351-Y368 PolarHBondContact OD1-N 3.08Å; T366-Y368 VanDerWaalsContact C-N 3.35Å; T366-Y368 WeakPolarHBondContact CB-O 3.45Å; T366-Y368 PolarHBondContact OG1-O 3.02Å; T366-Y368 VanDerWaalsContact OG1-O 3.06Å; Y368-I370 PolarHBondContact O-N 3.49Å
369	P	96.8	Very high	96.4	Very high	65 Å²	65	56.2 Å²	56.2	42%	0.422	26%	0.264	S	S	.	.			trans	-72.7	58.4	-174.1	31.8	-39.1	0	0	0	114	A330 F371 N372 Q373	A330-P369 HydrophobicContact CB-CG 4.01Å; P369-F371 PolarHBondContact O-N 3.18Å; P369-N372 HydrophobicContact CB-CB 4.42Å; P369-N372 PolarHBondContact O-N 2.87Å; P369-Q373 PolarHBondContact O-N 2.97Å
370	I	97.9	Very high	96.5	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-56.7	-45.5	-175.1	-173.3	170.1	0	0	0	112	M329 A349 D351 T366 Y368 N372 Q373 Y374 I388	M329-I370 HydrophobicContact CE-CG1 4.24Å; M329-I370 HydrophobicContact SD-CG1 4.13Å; A349-I370 HydrophobicContact CB-CD1 3.83Å; A349-I370 HydrophobicContact CB-CG1 4.35Å; D351-I370 HydrophobicContact CB-CB 4.2Å; D351-I370 HydrophobicContact CB-CD1 3.8Å; D351-I370 HydrophobicContact CB-CG2 3.98Å; T366-I370 HydrophobicContact CG2-CG2 3.96Å; Y368-I370 PolarHBondContact O-N 3.49Å; I370-N372 PolarHBondContact O-N 3.41Å; I370-Q373 PolarHBondContact O-N 2.99Å; I370-Y374 WeakPolarHBondContact O-CB 3.3Å; I370-Y374 PolarHBondContact O-N 3.12Å; I370-I388 HydrophobicContact CD1-CG2 3.95Å
371	F	98.1	Very high	96.6	Very high	12 Å²	12	60.5 Å²	60.5	5%	0.053	28%	0.282	C	S	.	.	H	α-helix	trans	-67.7	-37.9	-176.9	-59.6	-63.9	0	0	0	112.6	L244 F251 W256 W362 Y363 T366 P369 Q375 I388	L244-F371 HydrophobicContact CD1-CE1 3.92Å; L244-F371 HydrophobicContact CD1-CZ 4.41Å; F251-F371 AromaticContact CE1-CD1 3.99Å; F251-F371 HydrophobicContact CE1-CD1 3.99Å; F251-F371 AromaticContact CE1-CE1 3.44Å; F251-F371 HydrophobicContact CE1-CE1 3.44Å; F251-F371 VanDerWaalsContact CE1-CE1 3.44Å; F251-F371 AromaticContact CE1-CZ 3.88Å; F251-F371 HydrophobicContact CE1-CZ 3.88Å; F251-F371 AromaticContact CZ-CE1 3.55Å; F251-F371 HydrophobicContact CZ-CE1 3.55Å; F251-F371 AromaticContact CZ-CZ 3.6Å; F251-F371 HydrophobicContact CZ-CZ 3.6Å; W256-F371 AromaticContact CH2-CD1 3.95Å; W256-F371 HydrophobicContact CH2-CD1 3.95Å; W256-F371 HydrophobicContact CZ2-CD1 4.13Å; W362-F371 HydrophobicContact CD2-CZ 4.48Å; W362-F371 HydrophobicContact CE3-CZ 4.1Å; W362-F371 HydrophobicContact CH2-CE1 4.32Å; W362-F371 AromaticContact CH2-CZ 3.73Å; W362-F371 HydrophobicContact CH2-CZ 3.73Å; W362-F371 HydrophobicContact CZ2-CZ 4.08Å; W362-F371 HydrophobicContact CZ3-CE1 4.44Å; W362-F371 AromaticContact CZ3-CZ 3.72Å; W362-F371 HydrophobicContact CZ3-CZ 3.72Å; Y363-F371 HydrophobicContact CD2-CD1 4.4Å; Y363-F371 AromaticContact CD2-CD2 3.56Å; Y363-F371 HydrophobicContact CD2-CD2 3.56Å; Y363-F371 HydrophobicContact CD2-CE1 4.3Å; Y363-F371 AromaticContact CD2-CE2 3.45Å; Y363-F371 HydrophobicContact CD2-CE2 3.45Å; Y363-F371 VanDerWaalsContact CD2-CE2 3.45Å; Y363-F371 HydrophobicContact CD2-CG 4.07Å; Y363-F371 AromaticContact CD2-CZ 3.84Å; Y363-F371 HydrophobicContact CD2-CZ 3.84Å; Y363-F371 HydrophobicContact CE2-CB 4.38Å; Y363-F371 HydrophobicContact CE2-CD1 4.33Å; Y363-F371 AromaticContact CE2-CD2 3.7Å; Y363-F371 HydrophobicContact CE2-CD2 3.7Å; Y363-F371 HydrophobicContact CE2-CE2 4.08Å; Y363-F371 AromaticContact CE2-CG 3.86Å; Y363-F371 HydrophobicContact CE2-CG 3.86Å; Y363-F371 HydrophobicContact CG-CE2 4.25Å; T366-F371 HydrophobicContact CG2-CD2 3.75Å; T366-F371 HydrophobicContact CG2-CE2 3.43Å; T366-F371 VanDerWaalsContact CG2-CE2 3.43Å; P369-F371 PolarHBondContact O-N 3.18Å; F371-Q375 WeakPolarHBondContact O-CB 3.26Å; F371-Q375 WeakPolarHBondContact O-CG 3.48Å; F371-Q375 PolarHBondContact O-N 2.96Å; F371-I388 HydrophobicContact CD1-CD1 4.03Å; F371-I388 HydrophobicContact CE1-CD1 3.95Å
372	N	97.4	Very high	96.7	Very high	93 Å²	93	59.2 Å²	59.2	50%	0.497	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-48.8	176.9	-174.7	-68.8	0	0	0	110.5	P369 I370 Q375 R376	P369-N372 HydrophobicContact CB-CB 4.42Å; P369-N372 PolarHBondContact O-N 2.87Å; I370-N372 PolarHBondContact O-N 3.41Å; N372-Q375 PolarHBondContact O-N 3.16Å; N372-R376 WeakPolarHBondContact O-CG 3.5Å; N372-R376 PolarHBondContact O-N 3.44Å; N372-R376 VanDerWaalsContact OD1-CD 3.29Å; N372-R376 WeakPolarHBondContact OD1-CD 3.42Å
373	Q	97.9	Very high	96.7	Very high	20 Å²	20	67.6 Å²	67.6	9%	0.093	32%	0.322	C	S	.	.	H	α-helix	trans	-67.3	-38.7	-179.6	-65.1	-65.7	2.6	0	0	112.1	M329 P369 I370 R376 Y377	M329-Q373 HydrophobicContact CB-CB 3.99Å; M329-Q373 HydrophobicContact CB-CG 4.36Å; M329-Q373 HydrophobicContact CE-CB 3.87Å; M329-Q373 VanDerWaalsContact O-CD 3.32Å; M329-Q373 WeakPolarHBondContact O-CG 3.3Å; P369-Q373 PolarHBondContact O-N 2.97Å; I370-Q373 PolarHBondContact O-N 2.99Å; Q373-R376 PolarHBondContact O-N 3.36Å; Q373-Y377 WeakPolarHBondContact O-CB 3.38Å; Q373-Y377 PolarHBondContact O-N 3.21Å
374	Y	98.5	Very high	96.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58	-50	173.3	-179.5	-92.8	0	0	0	111.6	W256 L260 L261 P262 I370 R376 Y377 R378 F386 I388	W256-Y374 HydrophobicContact CZ3-CD1 4.2Å; W256-Y374 HydrophobicContact CZ3-CE1 4.22Å; L260-Y374 HydrophobicContact CB-CE1 4.25Å; L260-Y374 PolarHBondContact O-OH 3.43Å; L260-Y374 VanDerWaalsContact O-OH 3.07Å; L261-Y374 HydrophobicContact CD2-CE1 3.83Å; P262-Y374 WeakPolarHBondContact CD-OH 3.17Å; I370-Y374 WeakPolarHBondContact O-CB 3.3Å; I370-Y374 PolarHBondContact O-N 3.12Å; Y374-R376 VanDerWaalsContact C-N 3.34Å; Y374-R376 PolarHBondContact O-N 3.4Å; Y374-Y377 PolarHBondContact O-N 3.47Å; Y374-R378 HydrophobicContact CD1-CG 3.99Å; Y374-R378 HydrophobicContact CD2-CG 4.46Å; Y374-R378 HydrophobicContact CE1-CG 3.55Å; Y374-R378 HydrophobicContact CE2-CG 4.09Å; Y374-R378 HydrophobicContact CG-CG 4.41Å; Y374-R378 WeakPolarHBondContact O-CG 3.24Å; Y374-R378 PolarHBondContact O-N 3.2Å; Y374-F386 AromaticContact CD2-CD1 3.62Å; Y374-F386 HydrophobicContact CD2-CD1 3.62Å; Y374-F386 HydrophobicContact CD2-CD2 4.2Å; Y374-F386 AromaticContact CD2-CE1 3.53Å; Y374-F386 HydrophobicContact CD2-CE1 3.53Å; Y374-F386 HydrophobicContact CD2-CE2 4.15Å; Y374-F386 AromaticContact CD2-CG 3.98Å; Y374-F386 HydrophobicContact CD2-CG 3.98Å; Y374-F386 AromaticContact CD2-CZ 3.83Å; Y374-F386 HydrophobicContact CD2-CZ 3.83Å; Y374-F386 HydrophobicContact CE2-CB 4.1Å; Y374-F386 AromaticContact CE2-CD1 3.58Å; Y374-F386 HydrophobicContact CE2-CD1 3.58Å; Y374-F386 AromaticContact CE2-CD2 3.89Å; Y374-F386 HydrophobicContact CE2-CD2 3.89Å; Y374-F386 AromaticContact CE2-CE1 3.99Å; Y374-F386 HydrophobicContact CE2-CE1 3.99Å; Y374-F386 HydrophobicContact CE2-CE2 4.29Å; Y374-F386 AromaticContact CE2-CG 3.55Å; Y374-F386 HydrophobicContact CE2-CG 3.55Å; Y374-F386 HydrophobicContact CE2-CZ 4.35Å; Y374-F386 VanDerWaalsContact CE2-O 3.31Å; Y374-F386 WeakPolarHBondContact CE2-O 3.46Å; Y374-F386 HydrophobicContact CG-CE1 4.43Å; Y374-F386 PolarHBondContact OH-O 2.88Å; Y374-I388 HydrophobicContact CD1-CD1 4.16Å; Y374-I388 HydrophobicContact CD2-CD1 3.74Å; Y374-I388 HydrophobicContact CD2-CG1 3.73Å; Y374-I388 HydrophobicContact CE1-CD1 4.46Å; Y374-I388 HydrophobicContact CE2-CD1 4.07Å; Y374-I388 HydrophobicContact CE2-CG1 3.79Å; Y374-I388 HydrophobicContact CG-CD1 3.8Å; Y374-I388 HydrophobicContact CG-CG1 4.31Å
375	Q	98.3	Very high	96.9	Very high	33 Å²	33	63.3 Å²	63.3	15%	0.154	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-42.1	178.9	-71.1	175.8	45.8	0	0	112.2	W256 L260 F371 N372 R379	W256-Q375 HydrophobicContact CD2-CG 4Å; W256-Q375 HydrophobicContact CE3-CG 3.87Å; W256-Q375 HydrophobicContact CG-CG 4.42Å; W256-Q375 HydrophobicContact CZ3-CG 4.33Å; L260-Q375 HydrophobicContact CD1-CB 3.99Å; L260-Q375 HydrophobicContact CD1-CG 3.73Å; F371-Q375 WeakPolarHBondContact O-CB 3.26Å; F371-Q375 WeakPolarHBondContact O-CG 3.48Å; F371-Q375 PolarHBondContact O-N 2.96Å; N372-Q375 PolarHBondContact O-N 3.16Å; Q375-R379 VanDerWaalsContact O-CG 3.29Å; Q375-R379 WeakPolarHBondContact O-CG 3.49Å; Q375-R379 PolarHBondContact O-N 2.9Å
376	R	97.9	Very high	97.3	Very high	119 Å²	119	56.8 Å²	56.8	45%	0.449	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176	-70.9	175.1	71.9	-174.9	2.5	111.2	L337 N372 Q373 Y374 R379 L380	L337-R376 HydrophobicContact CD1-CB 4.17Å; L337-R376 HydrophobicContact CD2-CB 4Å; N372-R376 WeakPolarHBondContact O-CG 3.5Å; N372-R376 PolarHBondContact O-N 3.44Å; N372-R376 VanDerWaalsContact OD1-CD 3.29Å; N372-R376 WeakPolarHBondContact OD1-CD 3.42Å; Q373-R376 PolarHBondContact O-N 3.36Å; Y374-R376 VanDerWaalsContact C-N 3.34Å; Y374-R376 PolarHBondContact O-N 3.4Å; R376-R379 PolarHBondContact O-N 3.24Å; R376-L380 WeakPolarHBondContact O-CG 3.26Å; R376-L380 PolarHBondContact O-N 3.09Å
377	Y	98.3	Very high	97.4	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-48.3	179.6	-169.6	-84.2	0	0	0	112.4	F336 L337 Y342 L347 Q373 Y374 R379 L380 H381 Q384 F386	F336-Y377 HydrophobicContact CD1-CD2 4.29Å; F336-Y377 AromaticContact CE1-CD2 3.62Å; F336-Y377 HydrophobicContact CE1-CD2 3.62Å; F336-Y377 AromaticContact CE1-CG 3.94Å; F336-Y377 HydrophobicContact CE1-CG 3.94Å; F336-Y377 HydrophobicContact CE2-CD2 4.03Å; F336-Y377 HydrophobicContact CE2-CE2 4.17Å; F336-Y377 AromaticContact CZ-CD2 3.45Å; F336-Y377 HydrophobicContact CZ-CD2 3.45Å; F336-Y377 VanDerWaalsContact CZ-CD2 3.45Å; F336-Y377 HydrophobicContact CZ-CE2 4.03Å; F336-Y377 AromaticContact CZ-CG 3.77Å; F336-Y377 HydrophobicContact CZ-CG 3.77Å; L337-Y377 HydrophobicContact CD2-CD2 4.15Å; Y342-Y377 PolarHBondContact O-OH 3.11Å; L347-Y377 HydrophobicContact CD1-CD1 4.32Å; L347-Y377 HydrophobicContact CD1-CE1 3.58Å; L347-Y377 HydrophobicContact CD1-CE2 4.2Å; Q373-Y377 WeakPolarHBondContact O-CB 3.38Å; Q373-Y377 PolarHBondContact O-N 3.21Å; Y374-Y377 PolarHBondContact O-N 3.47Å; Y377-R379 PolarHBondContact O-N 2.94Å; Y377-L380 WeakPolarHBondContact O-CA 3.22Å; Y377-L380 WeakPolarHBondContact O-CB 3.49Å; Y377-L380 PolarHBondContact O-N 3.22Å; Y377-H381 HydrophobicContact CD1-CB 4.18Å; Y377-H381 AromaticContact CD1-CD2 3.98Å; Y377-H381 AromaticContact CD2-CD2 3.91Å; Y377-H381 HydrophobicContact CE1-CB 3.67Å; Y377-H381 AromaticContact CE1-CD2 3.6Å; Y377-H381 AromaticContact CE1-CG 3.84Å; Y377-H381 AromaticContact CE2-CD2 3.51Å; Y377-H381 AromaticContact CE2-NE2 3.94Å; Y377-H381 AromaticContact CZ-CD2 3.33Å; Y377-H381 AromaticContact CZ-CG 3.81Å; Y377-H381 PolarHBondContact O-N 2.96Å; Y377-Q384 PolarHBondContact OH-OE1 3.25Å; Y377-F386 AromaticContact CD1-CD1 3.54Å; Y377-F386 HydrophobicContact CD1-CD1 3.54Å; Y377-F386 AromaticContact CD1-CE1 3.79Å; Y377-F386 HydrophobicContact CD1-CE1 3.79Å; Y377-F386 HydrophobicContact CE1-CD1 4.15Å; Y377-F386 HydrophobicContact CG-CD1 4.2Å; Y377-F386 AromaticContact CG-CE1 3.99Å; Y377-F386 HydrophobicContact CG-CE1 3.99Å
378	R	97.8	Very high	97.5	Very high	31 Å²	31	53 Å²	53	12%	0.117	25%	0.253	C	S	.	.	H	α-helix	trans	-60.9	-31.3	-179.7	-70.5	-67.8	-61.6	127.8	4.5	113	L260 Y374 L380 H381 P382 Q384 F386	L260-R378 HydrophobicContact CB-CB 4.31Å; L260-R378 HydrophobicContact CB-CG 4.42Å; L260-R378 HydrophobicContact CD2-CB 3.91Å; L260-R378 PolarHBondContact O-NE 3.24Å; Y374-R378 HydrophobicContact CD1-CG 3.99Å; Y374-R378 HydrophobicContact CD2-CG 4.46Å; Y374-R378 HydrophobicContact CE1-CG 3.55Å; Y374-R378 HydrophobicContact CE2-CG 4.09Å; Y374-R378 HydrophobicContact CG-CG 4.41Å; Y374-R378 WeakPolarHBondContact O-CG 3.24Å; Y374-R378 PolarHBondContact O-N 3.2Å; R378-L380 VanDerWaalsContact C-N 3.34Å; R378-H381 PolarHBondContact NH1-O 3.07Å; R378-H381 CarbonylContact O-C 3.5Å; R378-P382 VanDerWaalsContact NH1-C 3.29Å; R378-P382 PolarHBondContact NH1-O 3.29Å; R378-P382 PolarHBondContact NH2-O 3.4Å; R378-P382 VanDerWaalsContact O-CA 3.26Å; R378-P382 WeakPolarHBondContact O-CA 3.37Å; R378-Q384 PolarHBondContact NH1-O 3.49Å; R378-F386 HydrophobicContact CG-CD1 4.36Å
379	R	96.9	Very high	97.6	Very high	168 Å²	168	49.3 Å²	49.3	63%	0.634	24%	0.239	S	C	*	.	H	α-helix	trans	-67.8	-33.4	173.3	-71.9	172.6	-172.4	169.3	5.8	112.7	Q375 R376 Y377	Q375-R379 VanDerWaalsContact O-CG 3.29Å; Q375-R379 WeakPolarHBondContact O-CG 3.49Å; Q375-R379 PolarHBondContact O-N 2.9Å; R376-R379 PolarHBondContact O-N 3.24Å; Y377-R379 PolarHBondContact O-N 2.94Å
380	L	96.9	Very high	97.6	Very high	105 Å²	105	46.9 Å²	46.9	55%	0.55	22%	0.221	S	C	.	.	H	α-helix	trans	-80.9	-32.8	177.2	-63.6	172.2	0	0	0	112.1	L337 R376 Y377 R378 P382	L337-L380 HydrophobicContact CB-CD1 4.31Å; R376-L380 WeakPolarHBondContact O-CG 3.26Å; R376-L380 PolarHBondContact O-N 3.09Å; Y377-L380 WeakPolarHBondContact O-CA 3.22Å; Y377-L380 WeakPolarHBondContact O-CB 3.49Å; Y377-L380 PolarHBondContact O-N 3.22Å; R378-L380 VanDerWaalsContact C-N 3.34Å; L380-P382 VanDerWaalsContact C-CD 3.48Å; L380-P382 WeakPolarHBondContact O-CD 3.22Å
381	H	97	Very high	97.5	Very high	55 Å²	55	47.1 Å²	47.1	26%	0.255	22%	0.223	S	C	.	.			trans	-128.6	61.2	-173.9	-56.4	-76.5	0	0	0	112.1	Y377 R378 Q383 Q384	Y377-H381 HydrophobicContact CD1-CB 4.18Å; Y377-H381 AromaticContact CD1-CD2 3.98Å; Y377-H381 AromaticContact CD2-CD2 3.91Å; Y377-H381 HydrophobicContact CE1-CB 3.67Å; Y377-H381 AromaticContact CE1-CD2 3.6Å; Y377-H381 AromaticContact CE1-CG 3.84Å; Y377-H381 AromaticContact CE2-CD2 3.51Å; Y377-H381 AromaticContact CE2-NE2 3.94Å; Y377-H381 AromaticContact CZ-CD2 3.33Å; Y377-H381 AromaticContact CZ-CG 3.81Å; Y377-H381 PolarHBondContact O-N 2.96Å; R378-H381 PolarHBondContact NH1-O 3.07Å; R378-H381 CarbonylContact O-C 3.5Å; H381-Q383 PolarHBondContact O-N 3.47Å; H381-Q384 HydrophobicContact CB-CB 4.21Å; H381-Q384 PolarHBondContact O-N 2.99Å
382	P	95.7	Very high	97.3	Very high	71 Å²	71	52.3 Å²	52.3	46%	0.461	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.7	-171.1	24.4	-34.5	0	0	0	113.7	R378 L380	R378-P382 VanDerWaalsContact NH1-C 3.29Å; R378-P382 PolarHBondContact NH1-O 3.29Å; R378-P382 PolarHBondContact NH2-O 3.4Å; R378-P382 VanDerWaalsContact O-CA 3.26Å; R378-P382 WeakPolarHBondContact O-CA 3.37Å; L380-P382 VanDerWaalsContact C-CD 3.48Å; L380-P382 WeakPolarHBondContact O-CD 3.22Å
383	Q	95.4	Very high	97.3	Very high	175 Å²	175	47.9 Å²	47.9	82%	0.818	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-16.6	-177.6	-58.7	-57.2	-27.7	0	0	113.9	H381 P385	H381-Q383 PolarHBondContact O-N 3.47Å; Q383-P385 WeakPolarHBondContact O-CD 3.36Å
384	Q	97.2	Very high	97.2	Very high	20 Å²	20	47.2 Å²	47.2	9%	0.093	22%	0.215	C	C	.	.	S	Bend	trans	-82.2	124.4	-178.6	-173	177.6	1.6	0	0	110.3	Y342 S344 G345 Y377 R378 H381 F386	Y342-Q384 PolarHBondContact O-NE2 3.27Å; Y342-Q384 PolarHBondContact O-OE1 2.92Å; S344-Q384 PolarHBondContact O-NE2 2.85Å; G345-Q384 VanDerWaalsContact O-CG 3.3Å; G345-Q384 WeakPolarHBondContact O-CG 3.45Å; G345-Q384 PolarHBondContact O-NE2 3.2Å; Y377-Q384 PolarHBondContact OH-OE1 3.25Å; R378-Q384 PolarHBondContact NH1-O 3.49Å; H381-Q384 HydrophobicContact CB-CB 4.21Å; H381-Q384 PolarHBondContact O-N 2.99Å; Q384-F386 PolarHBondContact O-N 3.15Å
385	P	97.3	Very high	97	Very high	55 Å²	55	47.7 Å²	47.7	36%	0.357	22%	0.217	S	C	.	.			trans	-61.4	127.2	176	-22	33.4	0	0	0	110.8	V346 L347 Q383 Y387	V346-P385 HydrophobicContact CG1-CB 4.12Å; V346-P385 HydrophobicContact CG2-CB 4.15Å; V346-P385 HydrophobicContact CG2-CG 4.36Å; L347-P385 PolarHBondContact N-O 3.25Å; Q383-P385 WeakPolarHBondContact O-CD 3.36Å; P385-Y387 HydrophobicContact CB-CE2 3.76Å
386	F	98.4	Very high	96.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	112.3	179.6	-174.9	-170.1	0	0	0	110	P262 M329 F336 L347 A349 Y374 Y377 R378 Q384	P262-F386 WeakPolarHBondContact CD-O 3.29Å; M329-F386 HydrophobicContact CE-CE1 4.2Å; M329-F386 HydrophobicContact CE-CZ 3.75Å; M329-F386 HydrophobicContact SD-CZ 4.13Å; F336-F386 HydrophobicContact CE1-CE1 4.46Å; F336-F386 AromaticContact CZ-CE1 3.76Å; F336-F386 HydrophobicContact CZ-CE1 3.76Å; F336-F386 AromaticContact CZ-CZ 3.79Å; F336-F386 HydrophobicContact CZ-CZ 3.79Å; L347-F386 HydrophobicContact CB-CB 4.08Å; L347-F386 HydrophobicContact CB-CD1 4.44Å; L347-F386 HydrophobicContact CB-CD2 3.25Å; L347-F386 HydrophobicContact CB-CE2 3.61Å; L347-F386 HydrophobicContact CB-CG 3.7Å; L347-F386 HydrophobicContact CB-CZ 4.35Å; L347-F386 HydrophobicContact CD1-CD1 4.33Å; L347-F386 HydrophobicContact CD1-CD2 4.45Å; L347-F386 HydrophobicContact CD1-CE1 4.36Å; L347-F386 HydrophobicContact CD1-CE2 4.45Å; L347-F386 HydrophobicContact CD1-CG 4.36Å; L347-F386 HydrophobicContact CD1-CZ 4.4Å; L347-F386 HydrophobicContact CG-CD2 4.47Å; L347-F386 VanDerWaalsContact O-CA 3.3Å; L347-F386 WeakPolarHBondContact O-CA 3.48Å; L347-F386 WeakPolarHBondContact O-CD2 3.31Å; A349-F386 HydrophobicContact CB-CE2 3.59Å; A349-F386 HydrophobicContact CB-CZ 3.95Å; Y374-F386 AromaticContact CD2-CD1 3.62Å; Y374-F386 HydrophobicContact CD2-CD1 3.62Å; Y374-F386 HydrophobicContact CD2-CD2 4.2Å; Y374-F386 AromaticContact CD2-CE1 3.53Å; Y374-F386 HydrophobicContact CD2-CE1 3.53Å; Y374-F386 HydrophobicContact CD2-CE2 4.15Å; Y374-F386 AromaticContact CD2-CG 3.98Å; Y374-F386 HydrophobicContact CD2-CG 3.98Å; Y374-F386 AromaticContact CD2-CZ 3.83Å; Y374-F386 HydrophobicContact CD2-CZ 3.83Å; Y374-F386 HydrophobicContact CE2-CB 4.1Å; Y374-F386 AromaticContact CE2-CD1 3.58Å; Y374-F386 HydrophobicContact CE2-CD1 3.58Å; Y374-F386 AromaticContact CE2-CD2 3.89Å; Y374-F386 HydrophobicContact CE2-CD2 3.89Å; Y374-F386 AromaticContact CE2-CE1 3.99Å; Y374-F386 HydrophobicContact CE2-CE1 3.99Å; Y374-F386 HydrophobicContact CE2-CE2 4.29Å; Y374-F386 AromaticContact CE2-CG 3.55Å; Y374-F386 HydrophobicContact CE2-CG 3.55Å; Y374-F386 HydrophobicContact CE2-CZ 4.35Å; Y374-F386 VanDerWaalsContact CE2-O 3.31Å; Y374-F386 WeakPolarHBondContact CE2-O 3.46Å; Y374-F386 HydrophobicContact CG-CE1 4.43Å; Y374-F386 PolarHBondContact OH-O 2.88Å; Y377-F386 AromaticContact CD1-CD1 3.54Å; Y377-F386 HydrophobicContact CD1-CD1 3.54Å; Y377-F386 AromaticContact CD1-CE1 3.79Å; Y377-F386 HydrophobicContact CD1-CE1 3.79Å; Y377-F386 HydrophobicContact CE1-CD1 4.15Å; Y377-F386 HydrophobicContact CG-CD1 4.2Å; Y377-F386 AromaticContact CG-CE1 3.99Å; Y377-F386 HydrophobicContact CG-CE1 3.99Å; R378-F386 HydrophobicContact CG-CD1 4.36Å; Q384-F386 PolarHBondContact O-N 3.15Å
387	Y	98.7	Very high	96.9	Very high	9 Å²	9	42 Å²	42	4%	0.035	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	161.1	-176.9	-56.5	-99.6	0	0	0	111.2	T243 P262 L266 D269 V346 L347 V348 A349 P385	T243-Y387 HydrophobicContact CG2-CD1 4.31Å; T243-Y387 HydrophobicContact CG2-CG 4.37Å; P262-Y387 HydrophobicContact CB-CD1 3.83Å; P262-Y387 HydrophobicContact CB-CE1 3.41Å; P262-Y387 VanDerWaalsContact CB-CE1 3.41Å; P262-Y387 HydrophobicContact CG-CD1 3.6Å; P262-Y387 HydrophobicContact CG-CE1 3.56Å; P262-Y387 HydrophobicContact CG-CE2 4.5Å; P262-Y387 HydrophobicContact CG-CG 4.11Å; L266-Y387 HydrophobicContact CB-CD1 3.72Å; L266-Y387 HydrophobicContact CB-CD2 4.29Å; L266-Y387 HydrophobicContact CB-CE1 3.91Å; L266-Y387 HydrophobicContact CB-CE2 4.46Å; L266-Y387 HydrophobicContact CB-CG 3.94Å; L266-Y387 HydrophobicContact CD1-CD1 4.48Å; L266-Y387 HydrophobicContact CD1-CD2 3.69Å; L266-Y387 HydrophobicContact CD1-CE2 4.28Å; L266-Y387 HydrophobicContact CD1-CG 3.82Å; L266-Y387 HydrophobicContact CG-CD1 4.5Å; L266-Y387 HydrophobicContact CG-CD2 4.19Å; L266-Y387 HydrophobicContact CG-CE2 4.34Å; L266-Y387 HydrophobicContact CG-CG 4.29Å; D269-Y387 VanDerWaalsContact CB-OH 3.3Å; D269-Y387 WeakPolarHBondContact CB-OH 3.17Å; D269-Y387 PolarHBondContact OD2-OH 2.85Å; V346-Y387 HydrophobicContact CG1-CD2 3.75Å; V346-Y387 HydrophobicContact CG1-CE2 3.7Å; L347-Y387 PolarHBondContact O-N 3.02Å; V348-Y387 CarbonylContact C-O 3.53Å; V348-Y387 WeakPolarHBondContact CA-O 3.24Å; A349-Y387 PolarHBondContact N-O 3.15Å; P385-Y387 HydrophobicContact CB-CE2 3.76Å
388	I	98.7	Very high	96.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.9	168.4	-57.2	175.6	0	0	0	107.1	T243 L244 L261 A349 W362 I370 F371 Y374	T243-I388 CarbonylContact C-O 3.6Å; T243-I388 WeakPolarHBondContact CA-O 3.39Å; T243-I388 WeakPolarHBondContact CB-O 3.43Å; L244-I388 HydrophobicContact CB-CB 4.42Å; L244-I388 HydrophobicContact CD1-CB 3.8Å; L244-I388 HydrophobicContact CD1-CD1 4.21Å; L244-I388 HydrophobicContact CD1-CG2 3.66Å; L244-I388 HydrophobicContact CG-CB 4.05Å; L244-I388 HydrophobicContact CG-CG2 4.1Å; L244-I388 PolarHBondContact N-O 2.53Å; L261-I388 HydrophobicContact CD2-CD1 4.33Å; A349-I388 HydrophobicContact CB-CG1 4.42Å; A349-I388 CarbonylContact O-C 3.54Å; A349-I388 WeakPolarHBondContact O-CA 3.42Å; W362-I388 HydrophobicContact CH2-CG2 3.88Å; I370-I388 HydrophobicContact CD1-CG2 3.95Å; F371-I388 HydrophobicContact CD1-CD1 4.03Å; F371-I388 HydrophobicContact CE1-CD1 3.95Å; Y374-I388 HydrophobicContact CD1-CD1 4.16Å; Y374-I388 HydrophobicContact CD2-CD1 3.74Å; Y374-I388 HydrophobicContact CD2-CG1 3.73Å; Y374-I388 HydrophobicContact CE1-CD1 4.46Å; Y374-I388 HydrophobicContact CE2-CD1 4.07Å; Y374-I388 HydrophobicContact CE2-CG1 3.79Å; Y374-I388 HydrophobicContact CG-CD1 3.8Å; Y374-I388 HydrophobicContact CG-CG1 4.31Å
389	L	98.3	Very high	96.6	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.016	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-62.6	140.4	175.6	-71.8	176.8	0	0	0	110.3	T243 L323 V348 A349 W350 L393	T243-L389 HydrophobicContact CG2-CD2 4.13Å; L323-L389 HydrophobicContact CD1-CD1 3.66Å; L323-L389 HydrophobicContact CD1-CG 4.45Å; V348-L389 HydrophobicContact CG1-CD1 4.11Å; V348-L389 HydrophobicContact CG1-CD2 3.83Å; V348-L389 HydrophobicContact CG1-CG 3.56Å; A349-L389 PolarHBondContact O-N 3.14Å; W350-L389 HydrophobicContact CB-CB 4.14Å; W350-L389 HydrophobicContact CB-CD1 4.08Å; W350-L389 HydrophobicContact CB-CG 4.48Å; L389-L393 HydrophobicContact CD1-CD2 4.06Å; L389-L393 HydrophobicContact CD2-CD2 4.17Å
390	H	97.3	Very high	96.5	Very high	13 Å²	13	36.5 Å²	36.5	6%	0.06	18%	0.178	C	C	.	.			trans	-70.1	128.1	171.7	-170.8	-73.3	0	0	0	109.1	T242 R392 L393	T242-H390 WeakPolarHBondContact O-CB 3.24Å; T242-H390 PolarHBondContact O-N 3.21Å; T242-H390 WeakPolarHBondContact OG1-CB 3.48Å; H390-R392 WeakPolarHBondContact ND1-CB 3.37Å; H390-R392 PolarHBondContact ND1-N 2.99Å; H390-R392 PolarHBondContact O-N 2.96Å; H390-L393 WeakPolarHBondContact O-CB 3.49Å; H390-L393 PolarHBondContact O-N 2.5Å; H390-L393 VanDerWaalsContact O-N 3.14Å
391	P	95.7	Very high	96.4	Very high	5 Å²	5	31.5 Å²	31.5	3%	0.032	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.3	-170.6	24.9	-36	0	0	0	114.4	A353 L359 W362 L393 E394	A353-P391 HydrophobicContact CB-CB 3.39Å; A353-P391 HydrophobicContact CB-CG 4.06Å; L359-P391 HydrophobicContact CD2-CG 3.88Å; W362-P391 HydrophobicContact CD2-CB 4.46Å; W362-P391 HydrophobicContact CD2-CG 3.95Å; W362-P391 HydrophobicContact CE3-CG 3.75Å; W362-P391 HydrophobicContact CG-CG 4.45Å; W362-P391 HydrophobicContact CH2-CG 4.46Å; W362-P391 HydrophobicContact CZ3-CG 4.02Å; P391-L393 PolarHBondContact O-N 3.29Å; P391-E394 WeakPolarHBondContact O-CB 3.44Å; P391-E394 PolarHBondContact O-N 3.15Å
392	R	94.7	Very high	96.2	Very high	121 Å²	121	29.1 Å²	29.1	46%	0.457	14%	0.14	S	C	.	.	H	α-helix	trans	-56.9	-35.5	174.2	-171.7	-174.7	-63.4	152	1.3	112.6	E240 H390 E394 W395 Q396	E240-R392 IonicContact OE2-CZ 2.82Å; E240-R392 IonicContact OE2-NH1 2.87Å; E240-R392 PolarHBondContact OE2-NH1 3.48Å; H390-R392 WeakPolarHBondContact ND1-CB 3.37Å; H390-R392 PolarHBondContact ND1-N 2.99Å; H390-R392 PolarHBondContact O-N 2.96Å; R392-E394 PolarHBondContact O-N 2.64Å; R392-W395 PolarHBondContact O-N 3.33Å; R392-Q396 VanDerWaalsContact CD-NE2 3.3Å; R392-Q396 HydrophobicContact CG-CG 3.87Å; R392-Q396 WeakPolarHBondContact O-CB 3.47Å; R392-Q396 WeakPolarHBondContact O-CG 3.49Å; R392-Q396 PolarHBondContact O-N 3.37Å
393	L	96	Very high	96	Very high	1 Å²	1	27 Å²	27	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-53.9	-43.7	178.5	171.9	59.4	0	0	0	111.2	V239 V241 L389 H390 P391 W395 L397 L419 I422	V239-L393 HydrophobicContact CG1-CD1 3.31Å; V241-L393 HydrophobicContact CG2-CD1 4.2Å; L389-L393 HydrophobicContact CD1-CD2 4.06Å; L389-L393 HydrophobicContact CD2-CD2 4.17Å; H390-L393 WeakPolarHBondContact O-CB 3.49Å; H390-L393 PolarHBondContact O-N 2.5Å; H390-L393 VanDerWaalsContact O-N 3.14Å; P391-L393 PolarHBondContact O-N 3.29Å; L393-W395 PolarHBondContact O-N 3.1Å; L393-L397 WeakPolarHBondContact O-CB 3.34Å; L393-L397 PolarHBondContact O-N 3.17Å; L393-L419 HydrophobicContact CD2-CD2 4.31Å; L393-L419 HydrophobicContact CG-CD2 4.04Å; L393-I422 HydrophobicContact CD1-CG2 4.23Å
394	E	96.2	Very high	95.8	Very high	5 Å²	5	19.1 Å²	19.1	2%	0.023	9%	0.089	C	C	.	.	H	α-helix	trans	-59.2	-47	-178.1	-60.5	172.3	-129.7	0	0	111.7	W350 D351 P352 P391 R392 W398 P413 P414 L419	W350-E394 HydrophobicContact CE3-CG 4.11Å; W350-E394 HydrophobicContact CZ3-CG 4.3Å; W350-E394 WeakPolarHBondContact CZ3-OE2 3.46Å; D351-E394 VanDerWaalsContact O-OE1 3.11Å; P352-E394 WeakPolarHBondContact CA-OE2 3.4Å; P391-E394 WeakPolarHBondContact O-CB 3.44Å; P391-E394 PolarHBondContact O-N 3.15Å; R392-E394 PolarHBondContact O-N 2.64Å; E394-W398 VanDerWaalsContact O-CB 3.31Å; E394-W398 WeakPolarHBondContact O-CB 3.24Å; E394-W398 PolarHBondContact O-N 3.22Å; E394-P413 HydrophobicContact CB-CB 4.11Å; E394-P413 HydrophobicContact CG-CB 4.44Å; E394-P413 VanDerWaalsContact OE2-CB 3.25Å; E394-P413 WeakPolarHBondContact OE2-CB 3.14Å; E394-P414 VanDerWaalsContact O-CD 3.24Å; E394-P414 WeakPolarHBondContact O-CD 3.49Å; E394-L419 HydrophobicContact CG-CD1 4.28Å; E394-L419 HydrophobicContact CG-CD2 4.19Å
395	W	95.4	Very high	95.5	Very high	10 Å²	10	18.9 Å²	18.9	4%	0.038	9%	0.088	C	C	.	.	H	α-helix	trans	-85.7	-31.1	-172.8	-62.4	120.7	0	0	0	113.4	Y210 V212 A353 F355 R392 L393 L397 W398 Q399	Y210-W395 HydrophobicContact CD1-CZ2 4.22Å; Y210-W395 HydrophobicContact CD2-CH2 4.02Å; Y210-W395 HydrophobicContact CD2-CZ2 4.29Å; Y210-W395 AromaticContact CG-CH2 3.88Å; Y210-W395 HydrophobicContact CG-CH2 3.88Å; Y210-W395 AromaticContact CG-CZ2 3.75Å; Y210-W395 HydrophobicContact CG-CZ2 3.75Å; V212-W395 HydrophobicContact CG2-CE3 4.39Å; V212-W395 HydrophobicContact CG2-CH2 3.81Å; V212-W395 HydrophobicContact CG2-CZ3 3.6Å; A353-W395 VanDerWaalsContact O-CE2 3.25Å; A353-W395 WeakPolarHBondContact O-CZ2 3.43Å; A353-W395 PolarHBondContact O-NE1 2.82Å; F355-W395 HydrophobicContact CB-CD2 4.46Å; F355-W395 HydrophobicContact CD2-CB 3.83Å; F355-W395 AromaticContact CD2-CD2 3.5Å; F355-W395 HydrophobicContact CD2-CD2 3.5Å; F355-W395 AromaticContact CD2-CE3 3.42Å; F355-W395 HydrophobicContact CD2-CE3 3.42Å; F355-W395 VanDerWaalsContact CD2-CE3 3.42Å; F355-W395 AromaticContact CD2-CG 3.68Å; F355-W395 HydrophobicContact CD2-CG 3.68Å; F355-W395 HydrophobicContact CD2-CZ3 4.13Å; F355-W395 HydrophobicContact CE2-CB 3.97Å; F355-W395 HydrophobicContact CE2-CD2 4.25Å; F355-W395 AromaticContact CE2-CE3 3.92Å; F355-W395 HydrophobicContact CE2-CE3 3.92Å; F355-W395 HydrophobicContact CE2-CG 4.3Å; F355-W395 HydrophobicContact CG-CD2 4.46Å; R392-W395 PolarHBondContact O-N 3.33Å; L393-W395 PolarHBondContact O-N 3.1Å; W395-L397 VanDerWaalsContact C-N 3.31Å; W395-W398 HydrophobicContact CE3-CB 3.83Å; W395-W398 HydrophobicContact CE3-CD2 4.33Å; W395-W398 AromaticContact CE3-CG 3.89Å; W395-W398 HydrophobicContact CE3-CG 3.89Å; W395-W398 HydrophobicContact CZ3-CB 4.37Å; W395-W398 HydrophobicContact CZ3-CD2 4.37Å; W395-W398 AromaticContact CZ3-CG 4Å; W395-W398 HydrophobicContact CZ3-CG 4Å; W395-W398 PolarHBondContact O-N 3.15Å; W395-Q399 VanDerWaalsContact O-CG 3.24Å; W395-Q399 WeakPolarHBondContact O-CG 3.17Å; W395-Q399 PolarHBondContact O-N 3.21Å
396	Q	96	Very high	95	Very high	32 Å²	32	21.1 Å²	21.1	15%	0.15	11%	0.111	C	C	.	.	H	α-helix	trans	-58.9	-47.9	167.3	-79.8	174.8	-27.1	0	0	110.1	V239 R392 Q399 R400	V239-Q396 HydrophobicContact CG1-CB 4.43Å; V239-Q396 HydrophobicContact CG2-CB 4.27Å; R392-Q396 VanDerWaalsContact CD-NE2 3.3Å; R392-Q396 HydrophobicContact CG-CG 3.87Å; R392-Q396 WeakPolarHBondContact O-CB 3.47Å; R392-Q396 WeakPolarHBondContact O-CG 3.49Å; R392-Q396 PolarHBondContact O-N 3.37Å; Q396-Q399 PolarHBondContact O-N 2.92Å; Q396-R400 WeakPolarHBondContact O-CG 3.48Å; Q396-R400 PolarHBondContact O-N 3.36Å; Q396-R400 VanDerWaalsContact O-N 3.12Å; Q396-R400 PolarHBondContact O-NE 2.85Å
397	L	96.8	Very high	94.6	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-66.5	-43.1	178.4	-175.9	59.5	0	0	0	112.2	L235 L393 W395 Q399 R400 I401 P414 L418 L419 I422	L235-L397 HydrophobicContact CD2-CD1 3.64Å; L393-L397 WeakPolarHBondContact O-CB 3.34Å; L393-L397 PolarHBondContact O-N 3.17Å; W395-L397 VanDerWaalsContact C-N 3.31Å; L397-Q399 VanDerWaalsContact C-N 3.29Å; L397-Q399 PolarHBondContact O-N 3.43Å; L397-R400 WeakPolarHBondContact O-CB 3.42Å; L397-R400 PolarHBondContact O-N 3.16Å; L397-I401 WeakPolarHBondContact O-CG1 3.42Å; L397-I401 PolarHBondContact O-N 2.99Å; L397-P414 HydrophobicContact CB-CG 4.17Å; L397-P414 HydrophobicContact CD2-CB 4.06Å; L397-P414 HydrophobicContact CD2-CG 3.99Å; L397-P414 HydrophobicContact CG-CB 4.46Å; L397-P414 HydrophobicContact CG-CG 3.96Å; L397-L418 HydrophobicContact CD1-CD2 4.02Å; L397-L418 HydrophobicContact CD2-CD2 3.78Å; L397-L418 HydrophobicContact CD2-CG 3.89Å; L397-L418 HydrophobicContact CG-CD2 3.94Å; L397-L419 HydrophobicContact CD2-CD2 3.9Å; L397-I422 HydrophobicContact CD1-CD1 4.35Å; L397-I422 HydrophobicContact CD1-CG1 3.97Å; L397-I422 HydrophobicContact CD2-CG1 3.98Å
398	W	96.9	Very high	94.3	Very high	5 Å²	5	24.6 Å²	24.6	2%	0.019	13%	0.131	C	C	.	.	H	α-helix	trans	-54.6	-45.5	174.1	-175.3	91.3	0	0	0	112	V212 V214 F355 E394 W395 R400 I401 Q402 I409 Q410 N412 P414	V212-W398 HydrophobicContact CG1-CE3 4.21Å; V212-W398 HydrophobicContact CG1-CH2 3.42Å; V212-W398 VanDerWaalsContact CG1-CH2 3.42Å; V212-W398 HydrophobicContact CG1-CZ2 3.8Å; V212-W398 HydrophobicContact CG1-CZ3 3.63Å; V214-W398 HydrophobicContact CG2-CH2 4.35Å; F355-W398 HydrophobicContact CE2-CE3 4.03Å; F355-W398 HydrophobicContact CE2-CZ3 4.43Å; F355-W398 HydrophobicContact CZ-CE3 4.43Å; F355-W398 HydrophobicContact CZ-CZ3 4.43Å; E394-W398 VanDerWaalsContact O-CB 3.31Å; E394-W398 WeakPolarHBondContact O-CB 3.24Å; E394-W398 PolarHBondContact O-N 3.22Å; W395-W398 HydrophobicContact CE3-CB 3.83Å; W395-W398 HydrophobicContact CE3-CD2 4.33Å; W395-W398 AromaticContact CE3-CG 3.89Å; W395-W398 HydrophobicContact CE3-CG 3.89Å; W395-W398 HydrophobicContact CZ3-CB 4.37Å; W395-W398 HydrophobicContact CZ3-CD2 4.37Å; W395-W398 AromaticContact CZ3-CG 4Å; W395-W398 HydrophobicContact CZ3-CG 4Å; W395-W398 PolarHBondContact O-N 3.15Å; W398-R400 VanDerWaalsContact C-N 3.32Å; W398-R400 PolarHBondContact O-N 3.09Å; W398-I401 WeakPolarHBondContact O-CB 3.12Å; W398-I401 PolarHBondContact O-N 3.4Å; W398-Q402 HydrophobicContact CE3-CB 4.3Å; W398-Q402 HydrophobicContact CH2-CB 3.94Å; W398-Q402 HydrophobicContact CH2-CG 3.88Å; W398-Q402 HydrophobicContact CZ2-CB 4.42Å; W398-Q402 HydrophobicContact CZ3-CB 3.9Å; W398-Q402 HydrophobicContact CZ3-CG 4.12Å; W398-Q402 PolarHBondContact O-N 3.36Å; W398-I409 HydrophobicContact CD2-CD1 4.23Å; W398-I409 HydrophobicContact CG-CD1 4.35Å; W398-I409 HydrophobicContact CH2-CG1 4.48Å; W398-I409 HydrophobicContact CZ2-CD1 4.06Å; W398-I409 HydrophobicContact CZ2-CG1 3.58Å; W398-Q410 PolarHBondContact NE1-O 3.47Å; W398-N412 PolarHBondContact NE1-O 3.22Å; W398-P414 HydrophobicContact CB-CG 4.27Å
399	Q	94	Very high	94	Very high	61 Å²	61	24.7 Å²	24.7	29%	0.285	13%	0.132	S	C	.	.	H	α-helix	trans	-63.5	-38	176.7	-70.2	172.2	0.6	0	0	111.8	F355 W395 Q396 L397 I401 Q402 D403	F355-Q399 HydrophobicContact CE2-CG 4.16Å; F355-Q399 HydrophobicContact CZ-CG 4.04Å; W395-Q399 VanDerWaalsContact O-CG 3.24Å; W395-Q399 WeakPolarHBondContact O-CG 3.17Å; W395-Q399 PolarHBondContact O-N 3.21Å; Q396-Q399 PolarHBondContact O-N 2.92Å; L397-Q399 VanDerWaalsContact C-N 3.29Å; L397-Q399 PolarHBondContact O-N 3.43Å; Q399-I401 VanDerWaalsContact C-N 3.3Å; Q399-I401 PolarHBondContact O-N 3.47Å; Q399-Q402 PolarHBondContact O-N 3.24Å; Q399-D403 VanDerWaalsContact O-CB 3.29Å; Q399-D403 WeakPolarHBondContact O-CB 3.37Å; Q399-D403 VanDerWaalsContact O-CG 3.25Å; Q399-D403 PolarHBondContact O-N 2.93Å
400	R	93.9	Very high	93.9	Very high	19 Å²	19	24.6 Å²	24.6	7%	0.072	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-36.3	175.4	-57.7	-45.3	92	-135.4	4.2	111.6	L235 V239 Q396 L397 W398 D403 N404	L235-R400 HydrophobicContact CD2-CB 3.99Å; L235-R400 HydrophobicContact CD2-CG 3.89Å; V239-R400 HydrophobicContact CG2-CG 3.71Å; Q396-R400 WeakPolarHBondContact O-CG 3.48Å; Q396-R400 PolarHBondContact O-N 3.36Å; Q396-R400 VanDerWaalsContact O-N 3.12Å; Q396-R400 PolarHBondContact O-NE 2.85Å; L397-R400 WeakPolarHBondContact O-CB 3.42Å; L397-R400 PolarHBondContact O-N 3.16Å; W398-R400 VanDerWaalsContact C-N 3.32Å; W398-R400 PolarHBondContact O-N 3.09Å; R400-D403 IonicContact CZ-OD2 3Å; R400-D403 IonicContact NH1-OD2 2.62Å; R400-D403 PolarHBondContact NH1-OD2 3.49Å; R400-D403 IonicContact NH2-OD2 2.76Å; R400-D403 PolarHBondContact NH2-OD2 3.4Å; R400-N404 PolarHBondContact O-ND2 3.29Å
401	I	94.9	Very high	93.8	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-55.9	172.4	-57.4	162.5	0	0	0	109.2	L397 W398 Q399 D403 N404 M405 I409 P414 L418 P464 E468 L471	L397-I401 WeakPolarHBondContact O-CG1 3.42Å; L397-I401 PolarHBondContact O-N 2.99Å; W398-I401 WeakPolarHBondContact O-CB 3.12Å; W398-I401 PolarHBondContact O-N 3.4Å; Q399-I401 VanDerWaalsContact C-N 3.3Å; Q399-I401 PolarHBondContact O-N 3.47Å; I401-D403 VanDerWaalsContact C-N 3.33Å; I401-D403 PolarHBondContact O-N 3.44Å; I401-N404 CarbonylContact O-C 3.53Å; I401-N404 PolarHBondContact O-N 3.42Å; I401-M405 HydrophobicContact CG2-CE 4.37Å; I401-M405 HydrophobicContact CG2-CG 4.3Å; I401-M405 WeakPolarHBondContact O-CG 3.43Å; I401-M405 PolarHBondContact O-N 3.41Å; I401-I409 HydrophobicContact CB-CD1 3.8Å; I401-I409 HydrophobicContact CG2-CD1 3.58Å; I401-I409 HydrophobicContact CG2-CG2 4.42Å; I401-P414 HydrophobicContact CD1-CB 4.18Å; I401-P414 HydrophobicContact CD1-CG 3.89Å; I401-L418 HydrophobicContact CD1-CD2 3.86Å; I401-L418 HydrophobicContact CG1-CD2 4.29Å; I401-P464 HydrophobicContact CD1-CG 4.29Å; I401-E468 HydrophobicContact CD1-CG 3.79Å; I401-L471 HydrophobicContact CB-CD2 4.36Å; I401-L471 HydrophobicContact CG1-CD2 3.8Å; I401-L471 HydrophobicContact CG2-CD1 4.4Å
402	Q	93.1	Very high	93.9	Very high	5 Å²	5	25.8 Å²	25.8	2%	0.023	14%	0.136	C	C	.	.	H	α-helix	trans	-59.1	-41.1	-175.9	179.5	60	86.2	0	0	112.7	V214 W398 Q399 N404 M405 E407 I409	V214-Q402 HydrophobicContact CG1-CG 4.21Å; W398-Q402 HydrophobicContact CE3-CB 4.3Å; W398-Q402 HydrophobicContact CH2-CB 3.94Å; W398-Q402 HydrophobicContact CH2-CG 3.88Å; W398-Q402 HydrophobicContact CZ2-CB 4.42Å; W398-Q402 HydrophobicContact CZ3-CB 3.9Å; W398-Q402 HydrophobicContact CZ3-CG 4.12Å; W398-Q402 PolarHBondContact O-N 3.36Å; Q399-Q402 PolarHBondContact O-N 3.24Å; Q402-N404 PolarHBondContact O-N 3.43Å; Q402-N404 VanDerWaalsContact O-N 3.16Å; Q402-M405 PolarHBondContact O-N 3.36Å; Q402-E407 PolarHBondContact NE2-O 3.43Å; Q402-E407 VanDerWaalsContact NE2-O 3.08Å; Q402-I409 HydrophobicContact CB-CD1 3.97Å; Q402-I409 HydrophobicContact CB-CG1 4.25Å
403	D	90.7	Very high	94	Very high	27 Å²	27	20 Å²	20	14%	0.144	11%	0.114	C	C	.	.	H	α-helix	trans	-63.8	-19.3	179.3	-77.8	3.9	0	0	0	112.8	R223 Q399 R400 I401	R223-D403 IonicContact NH1-OD2 3.46Å; R223-D403 PolarHBondContact NH1-OD2 2.82Å; Q399-D403 VanDerWaalsContact O-CB 3.29Å; Q399-D403 WeakPolarHBondContact O-CB 3.37Å; Q399-D403 VanDerWaalsContact O-CG 3.25Å; Q399-D403 PolarHBondContact O-N 2.93Å; R400-D403 IonicContact CZ-OD2 3Å; R400-D403 IonicContact NH1-OD2 2.62Å; R400-D403 PolarHBondContact NH1-OD2 3.49Å; R400-D403 IonicContact NH2-OD2 2.76Å; R400-D403 PolarHBondContact NH2-OD2 3.4Å; I401-D403 VanDerWaalsContact C-N 3.33Å; I401-D403 PolarHBondContact O-N 3.44Å
404	N	91.2	Very high	94.1	Very high	9 Å²	9	20 Å²	20	5%	0.048	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	13.7	-179.1	-75.9	-86.8	0	0	0	113.2	L226 Q234 R400 I401 Q402 L471	L226-N404 WeakPolarHBondContact CB-OD1 3.31Å; L226-N404 WeakPolarHBondContact CG-OD1 3.14Å; L226-N404 PolarHBondContact N-OD1 3.05Å; Q234-N404 PolarHBondContact OE1-ND2 3.45Å; R400-N404 PolarHBondContact O-ND2 3.29Å; I401-N404 CarbonylContact O-C 3.53Å; I401-N404 PolarHBondContact O-N 3.42Å; Q402-N404 PolarHBondContact O-N 3.43Å; Q402-N404 VanDerWaalsContact O-N 3.16Å; N404-L471 HydrophobicContact CB-CD1 4.24Å
405	M	90.5	Very high	94.3	Very high	16 Å²	16	20.3 Å²	20.3	8%	0.079	12%	0.117	C	C	.	.			trans	-118.6	140.9	178	-65.1	-55.3	139.3	0	0	112.1	I401 Q402 E407 I409 Y467 N470 L471	I401-M405 HydrophobicContact CG2-CE 4.37Å; I401-M405 HydrophobicContact CG2-CG 4.3Å; I401-M405 WeakPolarHBondContact O-CG 3.43Å; I401-M405 PolarHBondContact O-N 3.41Å; Q402-M405 PolarHBondContact O-N 3.36Å; M405-E407 PolarHBondContact O-N 2.98Å; M405-I409 HydrophobicContact CB-CG2 4.05Å; M405-I409 HydrophobicContact CG-CG2 3.8Å; M405-Y467 HydrophobicContact CG-CD1 3.78Å; M405-Y467 HydrophobicContact CG-CG 4.1Å; M405-Y467 HydrophobicContact SD-CD1 3.5Å; M405-Y467 VanDerWaalsContact SD-CD1 3.5Å; M405-Y467 HydrophobicContact SD-CE1 4.43Å; M405-Y467 HydrophobicContact SD-CG 4.14Å; M405-N470 HydrophobicContact CE-CB 4.02Å; M405-L471 HydrophobicContact CE-CD1 3.03Å
406	A	88.3	Confident	94.4	Very high	101 Å²	101	20.3 Å²	20.3	84%	0.835	12%	0.118	S	C	*	.	S	Bend	trans	-78.5	-5.4	177.3	0	0	0	0	0	113.7	T220	T220-A406 WeakPolarHBondContact CG2-O 3.48Å
407	E	89.3	Confident	94.5	Very high	38 Å²	38	19.3 Å²	19.3	18%	0.178	12%	0.116	C	C	.	.	S	Bend	trans	-136.1	158.9	178.1	65.6	-178.1	172.1	0	0	110.8	S189 S190 Q402 M405 I409 Y467	S189-E407 WeakPolarHBondContact CA-OE1 3.39Å; S189-E407 WeakPolarHBondContact CB-OE1 3.39Å; S190-E407 WeakPolarHBondContact CB-OE1 3.32Å; S190-E407 WeakPolarHBondContact CB-OE2 3.47Å; S190-E407 PolarHBondContact N-OE1 3.28Å; S190-E407 PolarHBondContact OG-OE1 3.35Å; S190-E407 PolarHBondContact OG-OE2 2.82Å; Q402-E407 PolarHBondContact NE2-O 3.43Å; Q402-E407 VanDerWaalsContact NE2-O 3.08Å; M405-E407 PolarHBondContact O-N 2.98Å; E407-I409 PolarHBondContact O-N 3.22Å; E407-Y467 VanDerWaalsContact CD-OH 3.23Å; E407-Y467 HydrophobicContact CG-CE1 4Å; E407-Y467 WeakPolarHBondContact OE1-CE1 3.44Å; E407-Y467 VanDerWaalsContact OE1-CZ 3.28Å; E407-Y467 PolarHBondContact OE1-OH 2.98Å
408	P	91.6	Very high	94.6	Very high	45 Å²	45	19.3 Å²	19.3	29%	0.292	12%	0.116	S	C	.	.	P	Polyproline II helix	trans	-61	134.4	173.8	-23	34.8	0	0	0	111.1	Q205 T220	Q205-P408 PolarHBondContact NE2-O 3.4Å; T220-P408 HydrophobicContact CG2-CG 4.4Å
409	I	94.4	Very high	94.7	Very high	1 Å²	1	19 Å²	19	1%	0.005	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-92.6	168.7	174.5	70.9	179.1	0	0	0	110.9	W398 I401 Q402 M405 E407 K411 P464 Y467	W398-I409 HydrophobicContact CD2-CD1 4.23Å; W398-I409 HydrophobicContact CG-CD1 4.35Å; W398-I409 HydrophobicContact CH2-CG1 4.48Å; W398-I409 HydrophobicContact CZ2-CD1 4.06Å; W398-I409 HydrophobicContact CZ2-CG1 3.58Å; I401-I409 HydrophobicContact CB-CD1 3.8Å; I401-I409 HydrophobicContact CG2-CD1 3.58Å; I401-I409 HydrophobicContact CG2-CG2 4.42Å; Q402-I409 HydrophobicContact CB-CD1 3.97Å; Q402-I409 HydrophobicContact CB-CG1 4.25Å; M405-I409 HydrophobicContact CB-CG2 4.05Å; M405-I409 HydrophobicContact CG-CG2 3.8Å; E407-I409 PolarHBondContact O-N 3.22Å; I409-K411 PolarHBondContact O-N 3.31Å; I409-P464 HydrophobicContact CB-CB 4.07Å; I409-P464 HydrophobicContact CD1-CB 4.03Å; I409-P464 HydrophobicContact CD1-CG 4.28Å; I409-P464 HydrophobicContact CG1-CB 4.32Å; I409-Y467 HydrophobicContact CB-CD2 3.78Å; I409-Y467 HydrophobicContact CB-CE2 3.95Å; I409-Y467 HydrophobicContact CB-CG 4.41Å; I409-Y467 HydrophobicContact CG2-CD1 4.05Å; I409-Y467 HydrophobicContact CG2-CD2 3.44Å; I409-Y467 VanDerWaalsContact CG2-CD2 3.44Å; I409-Y467 HydrophobicContact CG2-CE1 4.29Å; I409-Y467 HydrophobicContact CG2-CE2 3.73Å; I409-Y467 HydrophobicContact CG2-CG 3.6Å
410	Q	95.5	Very high	94.9	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-55.2	136.1	173.4	-64.6	92.5	-42.3	0	0	110.5	V201 W398 N412 A461 H463 Y467	V201-Q410 HydrophobicContact CG1-CG 4.38Å; W398-Q410 PolarHBondContact NE1-O 3.47Å; Q410-N412 HydrophobicContact CB-CB 4.46Å; Q410-N412 PolarHBondContact O-N 2.82Å; Q410-A461 PolarHBondContact NE2-O 3.5Å; Q410-H463 PolarHBondContact NE2-O 2.96Å; Q410-Y467 VanDerWaalsContact OE1-CE2 3.29Å
411	K	95.6	Very high	95.2	Very high	42 Å²	42	15.2 Å²	15.2	18%	0.183	10%	0.098	C	C	.	.	S	Bend	trans	-83.5	44.5	-177.4	-66.3	174.6	-175.7	146.1	0	111.9	Y204 Q205 N208 V212 I409	Y204-K411 PolarHBondContact O-N 3.28Å; Q205-K411 VanDerWaalsContact O-CE 3.28Å; Q205-K411 WeakPolarHBondContact O-CE 3.16Å; Q205-K411 PolarHBondContact O-NZ 3.37Å; N208-K411 HydrophobicContact CB-CD 3.91Å; V212-K411 HydrophobicContact CB-CB 4Å; V212-K411 HydrophobicContact CB-CD 4.36Å; V212-K411 HydrophobicContact CB-CG 4.1Å; V212-K411 HydrophobicContact CG1-CG 4.36Å; V212-K411 HydrophobicContact CG2-CB 3.88Å; V212-K411 HydrophobicContact CG2-CG 4.49Å; I409-K411 PolarHBondContact O-N 3.31Å
412	N	97.1	Very high	95.4	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.011	10%	0.098	C	C	.	.	S	Bend	trans	-128.7	151.4	-174.2	-63.8	71.5	0	0	0	108.1	W398 Q410 Y462	W398-N412 PolarHBondContact NE1-O 3.22Å; Q410-N412 HydrophobicContact CB-CB 4.46Å; Q410-N412 PolarHBondContact O-N 2.82Å; N412-Y462 HydrophobicContact CB-CD1 4.2Å; N412-Y462 HydrophobicContact CB-CE1 3.93Å; N412-Y462 HydrophobicContact CB-CE2 4.48Å; N412-Y462 WeakPolarHBondContact CB-O 3.25Å; N412-Y462 VanDerWaalsContact CG-O 3.32Å; N412-Y462 WeakPolarHBondContact ND2-CD2 3.4Å; N412-Y462 WeakPolarHBondContact ND2-CE2 3.36Å; N412-Y462 VanDerWaalsContact ND2-CZ 3.33Å
413	P	97.3	Very high	95.6	Very high	0 Å²	0	15 Å²	15	0%	0	10%	0.097	C	C	.	.	P	Polyproline II helix	trans	-63.1	156.7	-177.3	27.5	-36.4	0	0	0	111.9	W350 P352 E394 Y462 H463	W350-P413 HydrophobicContact CH2-CG 4.24Å; W350-P413 HydrophobicContact CZ3-CB 4.08Å; W350-P413 HydrophobicContact CZ3-CG 3.98Å; P352-P413 HydrophobicContact CB-CG 3.99Å; P352-P413 HydrophobicContact CG-CG 3.96Å; E394-P413 HydrophobicContact CB-CB 4.11Å; E394-P413 HydrophobicContact CG-CB 4.44Å; E394-P413 VanDerWaalsContact OE2-CB 3.25Å; E394-P413 WeakPolarHBondContact OE2-CB 3.14Å; P413-Y462 HydrophobicContact CG-CE1 4.28Å; P413-H463 PolarHBondContact O-ND1 3.12Å
414	P	98.4	Very high	96	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.09	C	C	.	.	P	Polyproline II helix	trans	-55.9	157	173.3	-23.4	34.9	0	0	0	112.4	E394 L397 W398 I401 L418 H463 E468	E394-P414 VanDerWaalsContact O-CD 3.24Å; E394-P414 WeakPolarHBondContact O-CD 3.49Å; L397-P414 HydrophobicContact CB-CG 4.17Å; L397-P414 HydrophobicContact CD2-CB 4.06Å; L397-P414 HydrophobicContact CD2-CG 3.99Å; L397-P414 HydrophobicContact CG-CB 4.46Å; L397-P414 HydrophobicContact CG-CG 3.96Å; W398-P414 HydrophobicContact CB-CG 4.27Å; I401-P414 HydrophobicContact CD1-CB 4.18Å; I401-P414 HydrophobicContact CD1-CG 3.89Å; P414-L418 HydrophobicContact CB-CD2 4.32Å; P414-H463 PolarHBondContact O-ND1 2.69Å; P414-E468 WeakPolarHBondContact CA-OE1 3.42Å
415	S	98.7	Very high	96.4	Very high	12 Å²	12	13.3 Å²	13.3	8%	0.084	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-64	155.1	177.4	79.1	0	0	0	0	111.8	G417 L418 L419 E468	S415-G417 PolarHBondContact O-N 2.94Å; S415-G417 VanDerWaalsContact O-N 3.1Å; S415-G417 PolarHBondContact OG-N 3.02Å; S415-L418 PolarHBondContact O-N 2.69Å; S415-L418 VanDerWaalsContact O-N 3.11Å; S415-L418 PolarHBondContact OG-N 3.06Å; S415-L419 WeakPolarHBondContact O-CG 3.05Å; S415-L419 PolarHBondContact O-N 2.99Å; S415-L419 VanDerWaalsContact O-N 3.07Å; S415-E468 VanDerWaalsContact CB-OE2 3.23Å; S415-E468 WeakPolarHBondContact CB-OE2 3.44Å; S415-E468 PolarHBondContact N-OE1 3.42Å; S415-E468 PolarHBondContact N-OE2 3.31Å; S415-E468 PolarHBondContact OG-OE2 3.37Å
416	S	98.7	Very high	96.7	Very high	9 Å²	9	14.1 Å²	14.1	6%	0.063	10%	0.096	C	C	.	.	H	α-helix	trans	-54	-31.6	170.2	-53.9	0	0	0	0	111.8	F303 L323 W350 L419 G420	F303-S416 WeakPolarHBondContact CE1-O 3.41Å; L323-S416 WeakPolarHBondContact CD2-O 3.14Å; W350-S416 VanDerWaalsContact CZ2-OG 3.22Å; W350-S416 WeakPolarHBondContact CZ2-OG 3.43Å; W350-S416 PolarHBondContact NE1-OG 2.86Å; S416-L419 PolarHBondContact O-N 3.4Å; S416-G420 PolarHBondContact O-N 2.92Å
417	G	98.6	Very high	97.2	Very high	11 Å²	11	9.5 Å²	9.5	11%	0.113	6%	0.057	C	C	.	.	H	α-helix	trans	-58.3	-48.2	177.1	0	0	0	0	0	112.9	S415 T421	S415-G417 PolarHBondContact O-N 2.94Å; S415-G417 VanDerWaalsContact O-N 3.1Å; S415-G417 PolarHBondContact OG-N 3.02Å; G417-T421 WeakPolarHBondContact O-CB 3.34Å; G417-T421 PolarHBondContact O-N 2.92Å; G417-T421 PolarHBondContact O-OG1 2.88Å
418	L	98.8	Very high	97.6	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-74.3	-40.7	178.3	-169.9	68.7	0	0	0	111.8	L397 I401 P414 S415 G420 T421 I422 F436 E468 V472	L397-L418 HydrophobicContact CD1-CD2 4.02Å; L397-L418 HydrophobicContact CD2-CD2 3.78Å; L397-L418 HydrophobicContact CD2-CG 3.89Å; L397-L418 HydrophobicContact CG-CD2 3.94Å; I401-L418 HydrophobicContact CD1-CD2 3.86Å; I401-L418 HydrophobicContact CG1-CD2 4.29Å; P414-L418 HydrophobicContact CB-CD2 4.32Å; S415-L418 PolarHBondContact O-N 2.69Å; S415-L418 VanDerWaalsContact O-N 3.11Å; S415-L418 PolarHBondContact OG-N 3.06Å; L418-G420 VanDerWaalsContact C-N 3.3Å; L418-G420 PolarHBondContact O-N 3.47Å; L418-T421 WeakPolarHBondContact O-CB 3.3Å; L418-T421 PolarHBondContact O-N 3.47Å; L418-T421 VanDerWaalsContact O-N 3.07Å; L418-I422 WeakPolarHBondContact O-CG1 3.22Å; L418-I422 PolarHBondContact O-N 3.47Å; L418-F436 HydrophobicContact CB-CZ 4.43Å; L418-E468 HydrophobicContact CB-CB 4.4Å; L418-E468 HydrophobicContact CB-CG 4.29Å; L418-E468 VanDerWaalsContact CB-OE2 3.3Å; L418-E468 WeakPolarHBondContact CB-OE2 3.4Å; L418-E468 HydrophobicContact CD2-CB 3.93Å; L418-E468 HydrophobicContact CD2-CG 3.67Å; L418-V472 HydrophobicContact CD1-CG2 3.7Å
419	L	98.8	Very high	97.9	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-56.2	-46.3	174.6	-65.8	173.3	0	0	0	111.4	L323 W350 L393 E394 L397 S415 S416 T421 I422 L423	L323-L419 HydrophobicContact CD2-CB 4.03Å; W350-L419 HydrophobicContact CD2-CD1 3.64Å; W350-L419 HydrophobicContact CE3-CD1 3.68Å; W350-L419 HydrophobicContact CG-CD1 4.25Å; W350-L419 HydrophobicContact CH2-CD1 4.02Å; W350-L419 HydrophobicContact CZ2-CD1 4.02Å; W350-L419 HydrophobicContact CZ3-CD1 3.86Å; L393-L419 HydrophobicContact CD2-CD2 4.31Å; L393-L419 HydrophobicContact CG-CD2 4.04Å; E394-L419 HydrophobicContact CG-CD1 4.28Å; E394-L419 HydrophobicContact CG-CD2 4.19Å; L397-L419 HydrophobicContact CD2-CD2 3.9Å; S415-L419 WeakPolarHBondContact O-CG 3.05Å; S415-L419 PolarHBondContact O-N 2.99Å; S415-L419 VanDerWaalsContact O-N 3.07Å; S416-L419 PolarHBondContact O-N 3.4Å; L419-T421 VanDerWaalsContact C-N 3.33Å; L419-T421 PolarHBondContact O-N 3.32Å; L419-I422 PolarHBondContact O-N 3.48Å; L419-L423 WeakPolarHBondContact O-CB 3.09Å; L419-L423 PolarHBondContact O-N 2.91Å
420	G	98.7	Very high	98.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-66.2	-33	176	0	0	0	0	0	113.1	S416 L418 M424	S416-G420 PolarHBondContact O-N 2.92Å; L418-G420 VanDerWaalsContact C-N 3.3Å; L418-G420 PolarHBondContact O-N 3.47Å; G420-M424 WeakPolarHBondContact O-CG 3.39Å; G420-M424 PolarHBondContact O-N 3.05Å
421	T	98.8	Very high	98.2	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-65.2	-49.7	175.1	-60.2	0	0	0	0	111.1	G417 L418 L419 L423 M424 M425 V433 L491	G417-T421 WeakPolarHBondContact O-CB 3.34Å; G417-T421 PolarHBondContact O-N 2.92Å; G417-T421 PolarHBondContact O-OG1 2.88Å; L418-T421 WeakPolarHBondContact O-CB 3.3Å; L418-T421 PolarHBondContact O-N 3.47Å; L418-T421 VanDerWaalsContact O-N 3.07Å; L419-T421 VanDerWaalsContact C-N 3.33Å; L419-T421 PolarHBondContact O-N 3.32Å; T421-L423 VanDerWaalsContact C-N 3.31Å; T421-L423 PolarHBondContact O-N 3.49Å; T421-M424 PolarHBondContact O-N 3.26Å; T421-M425 HydrophobicContact CG2-SD 4.24Å; T421-M425 WeakPolarHBondContact O-CG 2.97Å; T421-M425 PolarHBondContact O-N 3.19Å; T421-V433 HydrophobicContact CG2-CG2 3.79Å; T421-L491 HydrophobicContact CG2-CD1 3.45Å; T421-L491 VanDerWaalsContact CG2-CD1 3.45Å
422	I	98.6	Very high	98.4	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.7	-38.4	177.4	-61	-57.7	0	0	0	111.2	L235 V239 V241 L393 L397 L418 L419 M425 S426 F494	L235-I422 HydrophobicContact CD1-CD1 4.04Å; L235-I422 HydrophobicContact CD2-CD1 4.37Å; V239-I422 HydrophobicContact CG1-CG2 4.15Å; V241-I422 HydrophobicContact CG2-CG2 3.8Å; L393-I422 HydrophobicContact CD1-CG2 4.23Å; L397-I422 HydrophobicContact CD1-CD1 4.35Å; L397-I422 HydrophobicContact CD1-CG1 3.97Å; L397-I422 HydrophobicContact CD2-CG1 3.98Å; L418-I422 WeakPolarHBondContact O-CG1 3.22Å; L418-I422 PolarHBondContact O-N 3.47Å; L419-I422 PolarHBondContact O-N 3.48Å; I422-M425 HydrophobicContact CD1-SD 4.03Å; I422-M425 PolarHBondContact O-N 2.81Å; I422-S426 PolarHBondContact O-N 2.93Å; I422-F494 HydrophobicContact CD1-CZ 4.44Å; I422-F494 HydrophobicContact CG2-CE2 4.04Å; I422-F494 HydrophobicContact CG2-CZ 4.11Å
423	L	98.6	Very high	98.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-59	-48	172.1	175.1	62.4	0	0	0	111.9	V241 L266 L301 V348 L419 T421 M425 S426 L427	V241-L423 HydrophobicContact CG1-CD1 3.54Å; L266-L423 HydrophobicContact CD2-CD1 3.72Å; L301-L423 HydrophobicContact CD1-CD2 3.99Å; V348-L423 HydrophobicContact CG1-CD2 4.45Å; V348-L423 HydrophobicContact CG2-CD2 4.42Å; L419-L423 WeakPolarHBondContact O-CB 3.09Å; L419-L423 PolarHBondContact O-N 2.91Å; T421-L423 VanDerWaalsContact C-N 3.31Å; T421-L423 PolarHBondContact O-N 3.49Å; L423-M425 VanDerWaalsContact C-N 3.29Å; L423-M425 PolarHBondContact O-N 2.94Å; L423-S426 PolarHBondContact O-N 3.31Å; L423-S426 PolarHBondContact O-OG 3.47Å; L423-L427 HydrophobicContact CD1-CD1 4.12Å; L423-L427 HydrophobicContact CG-CD1 4.25Å; L423-L427 WeakPolarHBondContact O-CG 3.42Å
424	M	98.8	Very high	98.6	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-69.7	-28.9	179.2	-64.1	-51.2	-75	0	0	112.3	C276 V278 A299 L301 G420 T421 S426 L427 C428 V431	C276-M424 HydrophobicContact CB-CE 3.6Å; C276-M424 VanDerWaalsContact SG-CE 3.56Å; V278-M424 HydrophobicContact CG2-CB 3.81Å; V278-M424 HydrophobicContact CG2-CG 3.53Å; A299-M424 HydrophobicContact CB-CE 4Å; L301-M424 HydrophobicContact CB-CE 4.24Å; L301-M424 HydrophobicContact CB-CG 3.74Å; L301-M424 HydrophobicContact CB-SD 3.73Å; L301-M424 HydrophobicContact CD1-CG 3.74Å; L301-M424 HydrophobicContact CD1-SD 3.57Å; L301-M424 VanDerWaalsContact CD1-SD 3.57Å; L301-M424 HydrophobicContact CG-CG 4.27Å; L301-M424 HydrophobicContact CG-SD 4.26Å; G420-M424 WeakPolarHBondContact O-CG 3.39Å; G420-M424 PolarHBondContact O-N 3.05Å; T421-M424 PolarHBondContact O-N 3.26Å; M424-S426 PolarHBondContact O-N 2.87Å; M424-L427 PolarHBondContact O-N 2.97Å; M424-L427 VanDerWaalsContact O-N 3.13Å; M424-L427 HydrophobicContact SD-CD1 4.14Å; M424-C428 VanDerWaalsContact O-CB 3.3Å; M424-C428 WeakPolarHBondContact O-CB 3.47Å; M424-C428 PolarHBondContact O-N 2.96Å; M424-C428 PolarHBondContact O-SG 2.62Å; M424-V431 HydrophobicContact CB-CG1 4Å; M424-V431 HydrophobicContact CB-CG2 4.03Å; M424-V431 WeakPolarHBondContact O-CG2 3.33Å
425	M	98.5	Very high	98.6	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-65	-26.4	172.9	-70.6	171.7	72.1	0	0	112.5	L232 T421 I422 L423 L427 V431 L491 P492 G493 F494	L232-M425 HydrophobicContact CD2-CE 3.45Å; L232-M425 VanDerWaalsContact CD2-CE 3.45Å; T421-M425 HydrophobicContact CG2-SD 4.24Å; T421-M425 WeakPolarHBondContact O-CG 2.97Å; T421-M425 PolarHBondContact O-N 3.19Å; I422-M425 HydrophobicContact CD1-SD 4.03Å; I422-M425 PolarHBondContact O-N 2.81Å; L423-M425 VanDerWaalsContact C-N 3.29Å; L423-M425 PolarHBondContact O-N 2.94Å; M425-L427 VanDerWaalsContact C-N 3.34Å; M425-V431 HydrophobicContact CB-CG2 4.5Å; M425-V431 HydrophobicContact CG-CB 4.45Å; M425-V431 HydrophobicContact CG-CG2 3.96Å; M425-L491 HydrophobicContact CE-CB 4.43Å; M425-L491 HydrophobicContact CG-CB 4.47Å; M425-L491 HydrophobicContact SD-CB 4.26Å; M425-L491 HydrophobicContact SD-CD1 3.98Å; M425-P492 VanDerWaalsContact CE-O 3.23Å; M425-P492 WeakPolarHBondContact CE-O 3.32Å; M425-G493 CarbonylContact O-C 3.45Å; M425-G493 WeakPolarHBondContact O-CA 3.26Å; M425-F494 HydrophobicContact CB-CD1 4.46Å; M425-F494 HydrophobicContact CB-CD2 4.16Å; M425-F494 HydrophobicContact CB-CE1 4.32Å; M425-F494 HydrophobicContact CB-CE2 3.98Å; M425-F494 HydrophobicContact CB-CG 4.4Å; M425-F494 HydrophobicContact CB-CZ 4.08Å; M425-F494 HydrophobicContact CE-CD1 4.15Å; M425-F494 HydrophobicContact CE-CE1 3.62Å; M425-F494 HydrophobicContact CE-CZ 4.14Å; M425-F494 PolarHBondContact O-N 3.13Å
426	S	97.8	Very high	98.6	Very high	34 Å²	34	11.6 Å²	11.6	24%	0.238	7%	0.065	C	C	.	.	H	α-helix	trans	-81.3	-12.4	173.8	71.1	0	0	0	0	114	I422 L423 M424	I422-S426 PolarHBondContact O-N 2.93Å; L423-S426 PolarHBondContact O-N 3.31Å; L423-S426 PolarHBondContact O-OG 3.47Å; M424-S426 PolarHBondContact O-N 2.87Å
427	L	98	Very high	98.5	Very high	4 Å²	4	11.2 Å²	11.2	2%	0.021	6%	0.062	C	C	.	.	H	α-helix	trans	-111.3	-12.8	-174.4	-59.8	175.7	0	0	0	114.1	L266 T267 L270 P272 Y273 L423 M424 M425	L266-L427 HydrophobicContact CD2-CD1 3.76Å; L266-L427 HydrophobicContact CD2-CD2 3.88Å; L266-L427 HydrophobicContact CD2-CG 4.35Å; T267-L427 HydrophobicContact CG2-CD2 3.87Å; L270-L427 HydrophobicContact CB-CD1 4.41Å; L270-L427 HydrophobicContact CB-CD2 4.14Å; L270-L427 HydrophobicContact CD1-CD1 4.43Å; L270-L427 WeakPolarHBondContact O-CD2 3.41Å; P272-L427 CarbonylContact C-O 3.57Å; P272-L427 WeakPolarHBondContact CA-O 3.27Å; Y273-L427 HydrophobicContact CD2-CB 4.34Å; Y273-L427 PolarHBondContact N-O 2.64Å; L423-L427 HydrophobicContact CD1-CD1 4.12Å; L423-L427 HydrophobicContact CG-CD1 4.25Å; L423-L427 WeakPolarHBondContact O-CG 3.42Å; M424-L427 PolarHBondContact O-N 2.97Å; M424-L427 VanDerWaalsContact O-N 3.13Å; M424-L427 HydrophobicContact SD-CD1 4.14Å; M425-L427 VanDerWaalsContact C-N 3.34Å
428	C	98.3	Very high	98.4	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.8	-166	-46.9	0	0	0	0	111.4	Y273 C276 M424 V431 G493	Y273-C428 CarbonylContact O-C 3.58Å; Y273-C428 VanDerWaalsContact O-CA 3.22Å; Y273-C428 WeakPolarHBondContact O-CA 3.38Å; C276-C428 HydrophobicContact CB-CB 3.65Å; C276-C428 WeakPolarHBondContact CB-SG 3.26Å; C276-C428 WeakPolarHBondContact SG-CB 3.29Å; C276-C428 CovalentContact SG-SG 2Å; C276-C428 PolarHBondContact SG-SG 3.22Å; M424-C428 VanDerWaalsContact O-CB 3.3Å; M424-C428 WeakPolarHBondContact O-CB 3.47Å; M424-C428 PolarHBondContact O-N 2.96Å; M424-C428 PolarHBondContact O-SG 2.62Å; C428-V431 HydrophobicContact CB-CG2 4.01Å; C428-G493 WeakPolarHBondContact O-CA 3.48Å
429	E	97.9	Very high	98.2	Very high	99 Å²	99	11.2 Å²	11.2	46%	0.463	6%	0.06	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-36.7	173.9	-61	174.2	-170.4	0	0	112.3	Y273 K274 G493	Y273-E429 PolarHBondContact O-N 3.26Å; K274-E429 WeakPolarHBondContact O-CB 3.29Å; E429-G493 WeakPolarHBondContact O-CA 3.21Å; E429-G493 PolarHBondContact O-N 3Å
430	V	98.5	Very high	98	Very high	42 Å²	42	18.1 Å²	18.1	26%	0.255	9%	0.086	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	140.5	171.7	65.9	0	0	0	0	111.4	K274 C276 T490	K274-V430 WeakPolarHBondContact O-CG1 3.25Å; K274-V430 PolarHBondContact O-N 3.42Å; K274-V430 VanDerWaalsContact O-N 3.12Å; C276-V430 PolarHBondContact N-O 3.1Å; V430-T490 HydrophobicContact CG2-CG2 3.6Å
431	V	98.9	Very high	97.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122.1	179.1	-174.7	0	0	0	0	109.9	C276 V278 M424 M425 C428 V433 L491	C276-V431 CarbonylContact O-C 3.6Å; C276-V431 WeakPolarHBondContact O-CA 3.16Å; V278-V431 HydrophobicContact CG2-CG1 3.69Å; M424-V431 HydrophobicContact CB-CG1 4Å; M424-V431 HydrophobicContact CB-CG2 4.03Å; M424-V431 WeakPolarHBondContact O-CG2 3.33Å; M425-V431 HydrophobicContact CB-CG2 4.5Å; M425-V431 HydrophobicContact CG-CB 4.45Å; M425-V431 HydrophobicContact CG-CG2 3.96Å; C428-V431 HydrophobicContact CB-CG2 4.01Å; V431-V433 HydrophobicContact CG1-CG2 4.09Å; V431-L491 HydrophobicContact CB-CB 4.48Å; V431-L491 PolarHBondContact N-O 3.08Å; V431-L491 PolarHBondContact O-N 2.87Å
432	H	98.9	Very high	97.5	Very high	30 Å²	30	22.5 Å²	22.5	14%	0.139	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.2	168.6	-67.4	103.3	0	0	0	110.2	C276 A277 V278 H297 Y434 R488 V489 T490	C276-H432 PolarHBondContact O-N 2.95Å; A277-H432 CarbonylContact C-O 3.52Å; A277-H432 WeakPolarHBondContact CA-O 3.17Å; V278-H432 PolarHBondContact N-O 2.82Å; H297-H432 AromaticContact CD2-ND1 3.76Å; H297-H432 AromaticContact CE1-ND1 3.92Å; H297-H432 AromaticContact NE2-CE1 3.87Å; H297-H432 AromaticContact NE2-CG 3.53Å; H297-H432 AromaticContact NE2-ND1 2.87Å; H297-H432 PolarHBondContact NE2-ND1 3.45Å; H432-Y434 HydrophobicContact CB-CD2 4.42Å; H432-Y434 HydrophobicContact CB-CE2 3.61Å; H432-R488 HydrophobicContact CB-CG 4.18Å; H432-V489 CarbonylContact C-O 3.49Å; H432-V489 VanDerWaalsContact CA-O 3.26Å; H432-V489 WeakPolarHBondContact CA-O 3.45Å; H432-T490 PolarHBondContact CD2-OG1 3.23Å; H432-T490 PolarHBondContact NE2-OG1 3.28Å
433	V	98.9	Very high	97.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.4	179	-168.7	0	0	0	0	109.1	V278 T421 V431 F436 R488 V489 L491	V278-V433 HydrophobicContact CB-CB 4.43Å; V278-V433 HydrophobicContact CB-CG1 4.13Å; V278-V433 HydrophobicContact CB-CG2 4.23Å; V278-V433 HydrophobicContact CG1-CG1 4.09Å; V278-V433 WeakPolarHBondContact O-CA 3.46Å; T421-V433 HydrophobicContact CG2-CG2 3.79Å; V431-V433 HydrophobicContact CG1-CG2 4.09Å; V433-F436 HydrophobicContact CG1-CB 3.46Å; V433-F436 VanDerWaalsContact CG1-CB 3.46Å; V433-F436 HydrophobicContact CG1-CG 4.17Å; V433-R488 WeakPolarHBondContact O-CA 3.36Å; V433-V489 HydrophobicContact CB-CB 4.28Å; V433-V489 PolarHBondContact N-O 3.49Å; V433-V489 PolarHBondContact O-N 3.07Å; V433-L491 HydrophobicContact CG2-CD1 3.99Å
434	Y	98.9	Very high	96.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.3	-173.7	-67.1	-87.8	0	0	0	112.1	A277 V278 S280 L290 E293 I294 H297 H432 F436 G487 R488	A277-Y434 HydrophobicContact CB-CD2 4.13Å; A277-Y434 HydrophobicContact CB-CE2 3.74Å; V278-Y434 PolarHBondContact O-N 3.08Å; S280-Y434 VanDerWaalsContact CB-O 3.25Å; S280-Y434 WeakPolarHBondContact CB-O 3.5Å; S280-Y434 PolarHBondContact N-O 3.12Å; S280-Y434 VanDerWaalsContact N-O 3.14Å; S280-Y434 PolarHBondContact OG-O 3.18Å; L290-Y434 HydrophobicContact CD1-CD1 4.09Å; L290-Y434 HydrophobicContact CD2-CE1 4.42Å; E293-Y434 VanDerWaalsContact OE1-CE1 3.27Å; E293-Y434 WeakPolarHBondContact OE1-CE1 3.44Å; E293-Y434 PolarHBondContact OE1-OH 2.56Å; I294-Y434 HydrophobicContact CG1-CD1 4.44Å; I294-Y434 HydrophobicContact CG1-CD2 4.08Å; I294-Y434 HydrophobicContact CG1-CE1 4.38Å; I294-Y434 HydrophobicContact CG1-CE2 4.03Å; I294-Y434 HydrophobicContact CG1-CG 4.28Å; H297-Y434 PolarHBondContact CE1-OH 2.82Å; H432-Y434 HydrophobicContact CB-CD2 4.42Å; H432-Y434 HydrophobicContact CB-CE2 3.61Å; Y434-F436 PolarHBondContact O-N 2.81Å; Y434-F436 VanDerWaalsContact O-N 3.08Å; Y434-G487 CarbonylContact C-O 3.57Å; Y434-G487 WeakPolarHBondContact CA-O 3.32Å; Y434-R488 HydrophobicContact CD1-CB 4.16Å; Y434-R488 HydrophobicContact CD1-CG 4.22Å; Y434-R488 HydrophobicContact CE1-CB 4.05Å; Y434-R488 HydrophobicContact CE1-CG 3.79Å
435	E	98.6	Very high	96.7	Very high	3 Å²	3	26.8 Å²	26.8	1%	0.014	13%	0.13	C	C	.	.	S	Bend	trans	52.4	29.3	176.9	-64.9	-72.2	176.6	0	0	113.3	S280 A282 S284 L285 S439 R441 G487	S280-E435 WeakPolarHBondContact CB-O 3.5Å; S280-E435 VanDerWaalsContact OG-C 3.29Å; S280-E435 PolarHBondContact OG-O 2.72Å; A282-E435 HydrophobicContact CB-CB 4.27Å; S284-E435 WeakPolarHBondContact CB-OE2 3.11Å; S284-E435 VanDerWaalsContact OG-CD 3.24Å; S284-E435 PolarHBondContact OG-OE2 3.18Å; L285-E435 HydrophobicContact CD1-CB 4.48Å; L285-E435 HydrophobicContact CD2-CB 3.98Å; L285-E435 HydrophobicContact CD2-CG 3.57Å; L285-E435 HydrophobicContact CG-CB 3.82Å; L285-E435 HydrophobicContact CG-CG 3.73Å; E435-S439 VanDerWaalsContact OE1-CB 3.23Å; E435-S439 WeakPolarHBondContact OE1-CB 3.37Å; E435-S439 PolarHBondContact OE1-OG 3.24Å; E435-S439 PolarHBondContact OE2-N 3.1Å; E435-S439 VanDerWaalsContact OE2-N 3.15Å; E435-S439 PolarHBondContact OE2-OG 2.91Å; E435-R441 IonicContact OE1-CZ 2.86Å; E435-R441 IonicContact OE1-NE 2.69Å; E435-R441 PolarHBondContact OE1-NE 3.26Å; E435-R441 IonicContact OE1-NH2 3.32Å; E435-R441 PolarHBondContact OE1-NH2 3.42Å; E435-G487 PolarHBondContact N-O 3.35Å
436	F	98.4	Very high	96.5	Very high	11 Å²	11	27.1 Å²	27.1	5%	0.048	13%	0.133	C	C	.	.	S	Bend	trans	-80.9	-53.7	162.2	-171.7	-93	0	0	0	109.2	L418 V433 Y434 L465 E468 K469 V472	L418-F436 HydrophobicContact CB-CZ 4.43Å; V433-F436 HydrophobicContact CG1-CB 3.46Å; V433-F436 VanDerWaalsContact CG1-CB 3.46Å; V433-F436 HydrophobicContact CG1-CG 4.17Å; Y434-F436 PolarHBondContact O-N 2.81Å; Y434-F436 VanDerWaalsContact O-N 3.08Å; F436-L465 HydrophobicContact CE2-CD1 3.83Å; F436-L465 HydrophobicContact CZ-CD1 3.81Å; F436-E468 HydrophobicContact CE1-CB 4.42Å; F436-E468 HydrophobicContact CZ-CB 3.95Å; F436-K469 HydrophobicContact CD1-CG 3.98Å; F436-K469 HydrophobicContact CE1-CB 4.39Å; F436-K469 HydrophobicContact CE1-CG 3.6Å; F436-K469 HydrophobicContact CZ-CG 4.24Å; F436-K469 WeakPolarHBondContact O-CE 3.24Å; F436-K469 PolarHBondContact O-NZ 3.4Å; F436-V472 HydrophobicContact CD1-CB 4.1Å; F436-V472 HydrophobicContact CD1-CG1 4.01Å; F436-V472 HydrophobicContact CD1-CG2 3.96Å; F436-V472 HydrophobicContact CE1-CB 4Å; F436-V472 HydrophobicContact CE1-CG1 4.41Å; F436-V472 HydrophobicContact CE1-CG2 3.58Å; F436-V472 HydrophobicContact CZ-CG2 4.42Å
437	L	97.8	Very high	96.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-81.2	121.9	159	-59.3	-169.7	0	0	0	108.3	W184 K469 V472 K473 I483 V489	W184-L437 HydrophobicContact CB-CD1 4.5Å; W184-L437 HydrophobicContact CB-CD2 4.14Å; W184-L437 HydrophobicContact CD2-CD2 4.49Å; W184-L437 HydrophobicContact CG-CD2 4.02Å; L437-K469 HydrophobicContact CD2-CB 3.62Å; L437-K469 HydrophobicContact CD2-CD 4.39Å; L437-K469 HydrophobicContact CD2-CG 3.85Å; L437-V472 HydrophobicContact CD1-CG1 4.36Å; L437-V472 HydrophobicContact CD2-CG1 4.45Å; L437-V472 HydrophobicContact CG-CG1 4.16Å; L437-K473 HydrophobicContact CD1-CB 3.75Å; L437-K473 HydrophobicContact CD1-CD 4Å; L437-K473 HydrophobicContact CD1-CG 4.43Å; L437-I483 HydrophobicContact CB-CG2 3.78Å; L437-I483 HydrophobicContact CD1-CD1 3.9Å; L437-V489 HydrophobicContact CB-CG2 3.98Å; L437-V489 HydrophobicContact CD1-CG2 3.48Å; L437-V489 VanDerWaalsContact CD1-CG2 3.48Å; L437-V489 HydrophobicContact CG-CG2 3.65Å
438	P	95.2	Very high	96.5	Very high	10 Å²	10	27.8 Å²	27.8	7%	0.065	13%	0.132	C	C	.	.			trans	-72.3	139	-171.1	31.2	-35.9	0	0	0	110.7	F173 W184 K442 T458	F173-P438 HydrophobicContact CE1-CG 3.99Å; F173-P438 HydrophobicContact CZ-CG 3.69Å; W184-P438 HydrophobicContact CE3-CG 4Å; W184-P438 HydrophobicContact CZ3-CG 4.4Å; P438-K442 HydrophobicContact CB-CB 3.96Å; P438-T458 HydrophobicContact CG-CG2 4.42Å
439	S	96.1	Very high	96.5	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.021	14%	0.141	C	C	.	.			trans	-78.9	-170.8	174	71.3	0	0	0	0	112.6	E435 R441 K442 I483 Y484	E435-S439 VanDerWaalsContact OE1-CB 3.23Å; E435-S439 WeakPolarHBondContact OE1-CB 3.37Å; E435-S439 PolarHBondContact OE1-OG 3.24Å; E435-S439 PolarHBondContact OE2-N 3.1Å; E435-S439 VanDerWaalsContact OE2-N 3.15Å; E435-S439 PolarHBondContact OE2-OG 2.91Å; S439-R441 PolarHBondContact O-N 2.76Å; S439-R441 WeakPolarHBondContact OG-CB 3.29Å; S439-R441 PolarHBondContact OG-N 3.44Å; S439-R441 PolarHBondContact OG-NE 2.87Å; S439-R441 PolarHBondContact OG-NH2 2.97Å; S439-R441 VanDerWaalsContact OG-NH2 3.09Å; S439-K442 WeakPolarHBondContact O-CB 3.29Å; S439-K442 PolarHBondContact O-N 2.86Å; S439-I483 VanDerWaalsContact CA-O 3.29Å; S439-I483 WeakPolarHBondContact CA-O 3.46Å; S439-I483 WeakPolarHBondContact CB-O 3.38Å; S439-Y484 WeakPolarHBondContact CB-O 3.43Å
440	R	93.4	Very high	96.3	Very high	145 Å²	145	28.7 Å²	28.7	55%	0.547	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-15.5	165.8	74.7	-174.3	-173.8	-170.2	1.4	114.1	K442 Y484 N485	R440-K442 VanDerWaalsContact C-N 3.27Å; R440-Y484 HydrophobicContact CB-CD2 3.91Å; R440-Y484 HydrophobicContact CB-CE1 4.18Å; R440-Y484 HydrophobicContact CB-CE2 3.44Å; R440-Y484 VanDerWaalsContact CB-CE2 3.44Å; R440-Y484 HydrophobicContact CB-CG 4.47Å; R440-Y484 WeakPolarHBondContact CB-O 3.39Å; R440-Y484 WeakPolarHBondContact CG-O 3.42Å; R440-Y484 PolarHBondContact N-O 2.83Å; R440-N485 PolarHBondContact NH1-OD1 2.98Å
441	R	94.7	Very high	96	Very high	50 Å²	50	37.4 Å²	37.4	19%	0.189	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	9.1	174.1	-62	173.7	-69.8	-78.2	-5.8	113.4	S284 E435 S439 T443 N485 H486	S284-R441 WeakPolarHBondContact CB-O 3.49Å; S284-R441 WeakPolarHBondContact O-CD 3.36Å; S284-R441 PolarHBondContact O-NE 3.19Å; S284-R441 VanDerWaalsContact O-NE 3.14Å; E435-R441 IonicContact OE1-CZ 2.86Å; E435-R441 IonicContact OE1-NE 2.69Å; E435-R441 PolarHBondContact OE1-NE 3.26Å; E435-R441 IonicContact OE1-NH2 3.32Å; E435-R441 PolarHBondContact OE1-NH2 3.42Å; S439-R441 PolarHBondContact O-N 2.76Å; S439-R441 WeakPolarHBondContact OG-CB 3.29Å; S439-R441 PolarHBondContact OG-N 3.44Å; S439-R441 PolarHBondContact OG-NE 2.87Å; S439-R441 PolarHBondContact OG-NH2 2.97Å; S439-R441 VanDerWaalsContact OG-NH2 3.09Å; R441-T443 PolarHBondContact O-N 3.37Å; R441-N485 PolarHBondContact NH1-O 2.84Å; R441-N485 PolarHBondContact NH2-O 3.23Å; R441-H486 PolarHBondContact NH2-O 3.47Å
442	K	92.4	Very high	95.7	Very high	42 Å²	42	42.5 Å²	42.5	18%	0.183	19%	0.185	C	C	.	.			trans	-42.8	129.1	175.5	59.6	-172.3	172.5	172.9	0	111.4	F173 F174 P438 S439 R440	F173-K442 HydrophobicContact CD1-CD 3.99Å; F173-K442 HydrophobicContact CE1-CB 4.12Å; F173-K442 HydrophobicContact CE1-CD 3.7Å; F173-K442 HydrophobicContact CE1-CG 4.46Å; F173-K442 HydrophobicContact CZ-CD 4.04Å; F173-K442 WeakPolarHBondContact O-CD 3.37Å; F173-K442 WeakPolarHBondContact O-CE 3.45Å; F173-K442 PolarHBondContact O-NZ 3.32Å; F174-K442 HydrophobicContact CD1-CB 4.17Å; F174-K442 HydrophobicContact CD1-CG 4.42Å; F174-K442 HydrophobicContact CE1-CB 4.49Å; P438-K442 HydrophobicContact CB-CB 3.96Å; S439-K442 WeakPolarHBondContact O-CB 3.29Å; S439-K442 PolarHBondContact O-N 2.86Å; R440-K442 VanDerWaalsContact C-N 3.27Å
443	T	92.9	Very high	95.5	Very high	34 Å²	34	47.9 Å²	47.9	21%	0.209	21%	0.205	C	C	.	.			trans	-149.8	148.1	-171.6	175.9	0	0	0	0	110.1	F174 R441 L445	F174-T443 VanDerWaalsContact CD1-C 3.49Å; F174-T443 VanDerWaalsContact CE1-O 3.27Å; F174-T443 WeakPolarHBondContact CE1-O 3.45Å; R441-T443 PolarHBondContact O-N 3.37Å; T443-L445 HydrophobicContact CG2-CB 3.84Å; T443-L445 PolarHBondContact O-N 2.97Å; T443-L445 WeakPolarHBondContact OG1-CB 3.2Å; T443-L445 PolarHBondContact OG1-N 3.48Å; T443-L445 VanDerWaalsContact OG1-N 3.12Å
444	P	91.4	Very high	95.1	Very high	47 Å²	47	49.7 Å²	49.7	31%	0.305	21%	0.214	S	C	.	.	S	Bend	trans	-71.2	-6.3	169.9	28.6	-32.9	0	0	0	112.7	F174 C446 Y453 D454	F174-P444 HydrophobicContact CD2-CB 4.45Å; F174-P444 HydrophobicContact CE2-CB 4.32Å; P444-C446 PolarHBondContact O-N 2.85Å; P444-C446 VanDerWaalsContact O-N 3.15Å; P444-Y453 HydrophobicContact CG-CD1 4.13Å; P444-Y453 CarbonylContact O-C 3.56Å; P444-Y453 VanDerWaalsContact O-CA 3.24Å; P444-Y453 WeakPolarHBondContact O-CA 3.17Å; P444-D454 CarbonylContact O-C 3.55Å; P444-D454 PolarHBondContact O-N 2.86Å
445	L	95.3	Very high	94.7	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.042	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-60.5	117.5	173.1	-179.1	70.1	0	0	0	109.3	G283 R286 T443 Y453	G283-L445 VanDerWaalsContact CA-O 3.29Å; G283-L445 WeakPolarHBondContact CA-O 3.45Å; G283-L445 PolarHBondContact N-O 3.41Å; R286-L445 HydrophobicContact CG-CD2 4.39Å; T443-L445 HydrophobicContact CG2-CB 3.84Å; T443-L445 PolarHBondContact O-N 2.97Å; T443-L445 WeakPolarHBondContact OG1-CB 3.2Å; T443-L445 PolarHBondContact OG1-N 3.48Å; T443-L445 VanDerWaalsContact OG1-N 3.12Å; L445-Y453 HydrophobicContact CB-CD1 3.96Å; L445-Y453 HydrophobicContact CB-CE1 3.82Å; L445-Y453 HydrophobicContact CD1-CD1 4.24Å; L445-Y453 HydrophobicContact CD1-CE1 3.92Å; L445-Y453 HydrophobicContact CD1-CE2 4.21Å; L445-Y453 HydrophobicContact CG-CE1 4.46Å
446	C	94.7	Very high	94.4	Very high	7 Å²	7	50.7 Å²	50.7	5%	0.047	22%	0.223	C	C	.	.			trans	-66.2	-52.9	-171.4	-178.1	0	0	0	0	111.5	G283 P444 F452 C457	G283-C446 PolarHBondContact N-O 3.25Å; P444-C446 PolarHBondContact O-N 2.85Å; P444-C446 VanDerWaalsContact O-N 3.15Å; C446-F452 HydrophobicContact CB-CD1 3.59Å; C446-F452 HydrophobicContact CB-CE1 4.15Å; C446-F452 WeakPolarHBondContact CB-O 3.45Å; C446-F452 PolarHBondContact N-O 3.42Å; C446-C457 HydrophobicContact CB-CB 3.71Å; C446-C457 WeakPolarHBondContact CB-SG 3.47Å; C446-C457 WeakPolarHBondContact SG-CB 3.32Å; C446-C457 CovalentContact SG-SG 2.02Å; C446-C457 PolarHBondContact SG-SG 3.29Å
447	H	97.6	Very high	94.1	Very high	51 Å²	51	52.2 Å²	52.2	24%	0.236	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-129.1	144.5	-178.6	-55.6	118.3	0	0	0	113.3	S281 Y449 Q450	S281-H447 WeakPolarHBondContact O-CA 3.3Å; S281-H447 PolarHBondContact O-CD2 3.11Å; H447-Y449 HydrophobicContact CB-CD1 4Å; H447-Y449 HydrophobicContact CB-CE1 3.71Å; H447-Y449 HydrophobicContact CB-CE2 4.46Å; H447-Y449 PolarHBondContact O-N 3.46Å; H447-Y449 VanDerWaalsContact O-N 3.13Å; H447-Q450 HydrophobicContact CB-CB 4.21Å; H447-Q450 HydrophobicContact CB-CG 4.16Å; H447-Q450 PolarHBondContact ND1-OE1 2.84Å; H447-Q450 PolarHBondContact O-N 2.87Å
448	Y	98.3	Very high	93.7	Very high	1 Å²	1	52.9 Å²	52.9	0%	0.004	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.2	-179.4	66.7	-101.3	0	0	0	113.4	S281 L285 R286 A306 P307 F311 V315	S281-Y448 WeakPolarHBondContact O-CD1 3.23Å; S281-Y448 PolarHBondContact O-N 3.19Å; L285-Y448 HydrophobicContact CB-CD1 4.24Å; L285-Y448 HydrophobicContact CB-CG 4.42Å; L285-Y448 HydrophobicContact CD1-CD1 3.74Å; L285-Y448 HydrophobicContact CD1-CE1 4.06Å; R286-Y448 PolarHBondContact NE-O 3.47Å; R286-Y448 PolarHBondContact NH2-O 2.82Å; A306-Y448 HydrophobicContact CB-CE1 4.24Å; A306-Y448 WeakPolarHBondContact CB-OH 3.17Å; P307-Y448 HydrophobicContact CG-CE2 4.36Å; P307-Y448 VanDerWaalsContact O-CE2 3.31Å; P307-Y448 WeakPolarHBondContact O-CE2 3.5Å; P307-Y448 PolarHBondContact O-OH 3.46Å; F311-Y448 HydrophobicContact CB-CD2 4.24Å; F311-Y448 HydrophobicContact CB-CE2 4.08Å; F311-Y448 AromaticContact CD1-CD2 3.8Å; F311-Y448 HydrophobicContact CD1-CD2 3.8Å; F311-Y448 HydrophobicContact CD1-CE2 4.36Å; F311-Y448 HydrophobicContact CD2-CD2 4.2Å; F311-Y448 HydrophobicContact CD2-CE2 4.02Å; F311-Y448 HydrophobicContact CE1-CD2 4.2Å; F311-Y448 WeakPolarHBondContact CE1-O 3.38Å; F311-Y448 AromaticContact CG-CD2 3.8Å; F311-Y448 HydrophobicContact CG-CD2 3.8Å; F311-Y448 AromaticContact CG-CE2 3.88Å; F311-Y448 HydrophobicContact CG-CE2 3.88Å; V315-Y448 HydrophobicContact CG1-CD1 4.22Å; V315-Y448 HydrophobicContact CG1-CD2 4.15Å; V315-Y448 HydrophobicContact CG1-CE1 4.07Å; V315-Y448 HydrophobicContact CG1-CE2 4.01Å; V315-Y448 HydrophobicContact CG1-CG 4.26Å; V315-Y448 HydrophobicContact CG2-CE2 4.3Å
449	Y	96.9	Very high	93.6	Very high	52 Å²	52	52.5 Å²	52.5	20%	0.204	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	6.5	-178.7	58.4	-87.8	0	0	0	113.5	A306 P307 H447	A306-Y449 HydrophobicContact CB-CD1 4.39Å; A306-Y449 HydrophobicContact CB-CE1 3.8Å; P307-Y449 VanDerWaalsContact CD-CD1 3.45Å; P307-Y449 HydrophobicContact CG-CD1 4.44Å; P307-Y449 HydrophobicContact CG-CD2 4.46Å; P307-Y449 HydrophobicContact CG-CG 3.95Å; H447-Y449 HydrophobicContact CB-CD1 4Å; H447-Y449 HydrophobicContact CB-CE1 3.71Å; H447-Y449 HydrophobicContact CB-CE2 4.46Å; H447-Y449 PolarHBondContact O-N 3.46Å; H447-Y449 VanDerWaalsContact O-N 3.13Å
450	Q	94.1	Very high	93.4	Very high	67 Å²	67	52.5 Å²	52.5	31%	0.313	24%	0.237	S	C	.	.			trans	-122.1	174.6	-179.8	-65.4	-177.3	-25.8	0	0	111.9	R286 H447	R286-Q450 PolarHBondContact NH2-O 2.92Å; H447-Q450 HydrophobicContact CB-CB 4.21Å; H447-Q450 HydrophobicContact CB-CG 4.16Å; H447-Q450 PolarHBondContact ND1-OE1 2.84Å; H447-Q450 PolarHBondContact O-N 2.87Å
451	R	93.4	Very high	93.3	Very high	225 Å²	225	46.8 Å²	46.8	85%	0.849	22%	0.22	S	C	*	.			trans	-117.7	30.2	172.3	-62.3	-175.7	179.9	-179.1	1.6	111.5
452	F	91.8	Very high	93.4	Very high	107 Å²	107	47 Å²	47	47%	0.469	22%	0.222	S	C	.	.			trans	-102.2	131.5	-179.9	174.4	-112.5	0	0	0	110.6	C446 D454	C446-F452 HydrophobicContact CB-CD1 3.59Å; C446-F452 HydrophobicContact CB-CE1 4.15Å; C446-F452 WeakPolarHBondContact CB-O 3.45Å; C446-F452 PolarHBondContact N-O 3.42Å; F452-D454 HydrophobicContact CD1-CB 4.46Å; F452-D454 HydrophobicContact CE1-CB 3.55Å; F452-D454 HydrophobicContact CZ-CB 3.59Å
453	Y	94.3	Very high	93.6	Very high	143 Å²	143	47.2 Å²	47.2	56%	0.561	22%	0.223	S	C	*	.	B	Isolated β-bridge	trans	-114.9	116.3	-177.2	-64.4	-95.9	0	0	0	110	P444 L445	P444-Y453 HydrophobicContact CG-CD1 4.13Å; P444-Y453 CarbonylContact O-C 3.56Å; P444-Y453 VanDerWaalsContact O-CA 3.24Å; P444-Y453 WeakPolarHBondContact O-CA 3.17Å; L445-Y453 HydrophobicContact CB-CD1 3.96Å; L445-Y453 HydrophobicContact CB-CE1 3.82Å; L445-Y453 HydrophobicContact CD1-CD1 4.24Å; L445-Y453 HydrophobicContact CD1-CE1 3.92Å; L445-Y453 HydrophobicContact CD1-CE2 4.21Å; L445-Y453 HydrophobicContact CG-CE1 4.46Å
454	D	92	Very high	93.9	Very high	37 Å²	37	45.6 Å²	45.6	20%	0.198	21%	0.213	C	C	.	.			trans	-153	122.1	171.8	-166.9	-10.8	0	0	0	110.5	R196 P444 F452 A456 C457	R196-D454 IonicContact CZ-OD1 2.96Å; R196-D454 IonicContact NH1-OD1 3.94Å; R196-D454 PolarHBondContact NH1-OD1 2.94Å; R196-D454 IonicContact NH1-OD2 3.02Å; R196-D454 IonicContact NH2-OD1 2.62Å; R196-D454 PolarHBondContact NH2-OD1 3.32Å; P444-D454 CarbonylContact O-C 3.55Å; P444-D454 PolarHBondContact O-N 2.86Å; F452-D454 HydrophobicContact CD1-CB 4.46Å; F452-D454 HydrophobicContact CE1-CB 3.55Å; F452-D454 HydrophobicContact CZ-CB 3.59Å; D454-A456 VanDerWaalsContact CG-CB 3.49Å; D454-A456 PolarHBondContact O-N 3.5Å; D454-A456 VanDerWaalsContact O-N 3.17Å; D454-A456 VanDerWaalsContact OD1-CB 3.26Å; D454-A456 WeakPolarHBondContact OD1-CB 3.46Å; D454-A456 PolarHBondContact OD1-N 3.05Å; D454-A456 WeakPolarHBondContact OD2-CB 3.26Å; D454-C457 PolarHBondContact O-N 3.29Å; D454-C457 VanDerWaalsContact O-N 3.11Å
455	A	90.3	Very high	94.2	Very high	12 Å²	12	44.3 Å²	44.3	10%	0.099	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.7	173.5	0	0	0	0	0	112.5	D170 F174 L197 C457 T458 F459	D170-A455 HydrophobicContact CB-CB 4.41Å; F174-A455 HydrophobicContact CE2-CB 3.71Å; F174-A455 HydrophobicContact CZ-CB 4.16Å; L197-A455 HydrophobicContact CD1-CB 3.98Å; A455-C457 PolarHBondContact O-N 3.47Å; A455-T458 PolarHBondContact O-N 3.09Å; A455-F459 HydrophobicContact CB-CD2 4.14Å; A455-F459 HydrophobicContact CB-CE2 4.48Å; A455-F459 WeakPolarHBondContact O-CD2 3.5Å; A455-F459 PolarHBondContact O-N 2.95Å
456	A	91.3	Very high	94.3	Very high	12 Å²	12	44.1 Å²	44.1	10%	0.099	20%	0.203	C	C	.	.	H	α-helix	trans	-57.2	-29.5	175.1	0	0	0	0	0	112.9	L197 D454 T458 G460 A461	L197-A456 HydrophobicContact CD2-CB 3.75Å; D454-A456 VanDerWaalsContact CG-CB 3.49Å; D454-A456 PolarHBondContact O-N 3.5Å; D454-A456 VanDerWaalsContact O-N 3.17Å; D454-A456 VanDerWaalsContact OD1-CB 3.26Å; D454-A456 WeakPolarHBondContact OD1-CB 3.46Å; D454-A456 PolarHBondContact OD1-N 3.05Å; D454-A456 WeakPolarHBondContact OD2-CB 3.26Å; A456-T458 PolarHBondContact O-N 2.86Å; A456-G460 CarbonylContact O-C 3.59Å; A456-G460 WeakPolarHBondContact O-CA 3.43Å; A456-G460 PolarHBondContact O-N 2.98Å; A456-A461 HydrophobicContact CB-CB 3.88Å
457	C	91.4	Very high	94.4	Very high	44 Å²	44	44 Å²	44	30%	0.297	20%	0.201	S	C	.	.	H	α-helix	trans	-71	-20.4	177.5	-56.4	0	0	0	0	112.7	C446 D454 A455 L465	C446-C457 HydrophobicContact CB-CB 3.71Å; C446-C457 WeakPolarHBondContact CB-SG 3.47Å; C446-C457 WeakPolarHBondContact SG-CB 3.32Å; C446-C457 CovalentContact SG-SG 2.02Å; C446-C457 PolarHBondContact SG-SG 3.29Å; D454-C457 PolarHBondContact O-N 3.29Å; D454-C457 VanDerWaalsContact O-N 3.11Å; A455-C457 PolarHBondContact O-N 3.47Å; C457-L465 WeakPolarHBondContact O-CD2 2.99Å
458	T	90.8	Very high	94.4	Very high	13 Å²	13	41.5 Å²	41.5	8%	0.08	19%	0.19	C	C	.	.	H	α-helix	trans	-97.4	-39.4	176	-60.7	0	0	0	0	111.9	F173 F174 P438 A455 A456 K469	F173-T458 HydrophobicContact CE1-CG2 4.46Å; F174-T458 HydrophobicContact CE1-CG2 4.41Å; F174-T458 HydrophobicContact CZ-CG2 4.42Å; P438-T458 HydrophobicContact CG-CG2 4.42Å; A455-T458 PolarHBondContact O-N 3.09Å; A456-T458 PolarHBondContact O-N 2.86Å; T458-K469 WeakPolarHBondContact O-CE 3.47Å; T458-K469 PolarHBondContact O-NZ 3.42Å
459	F	91.8	Very high	94.4	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-98.3	-14.7	-175.5	-67.9	-69.1	0	0	0	114.3	D170 F173 F174 W184 M188 L193 L197 A455 L466	D170-F459 HydrophobicContact CB-CE2 4.19Å; F173-F459 HydrophobicContact CB-CE2 4.5Å; F173-F459 HydrophobicContact CB-CZ 3.76Å; F173-F459 HydrophobicContact CD1-CE1 4.19Å; F173-F459 HydrophobicContact CD1-CE2 4.08Å; F173-F459 AromaticContact CD1-CZ 3.36Å; F173-F459 HydrophobicContact CD1-CZ 3.36Å; F173-F459 HydrophobicContact CD2-CE1 4.37Å; F173-F459 HydrophobicContact CD2-CZ 4.07Å; F173-F459 HydrophobicContact CE1-CE1 4.34Å; F173-F459 AromaticContact CE1-CZ 3.88Å; F173-F459 HydrophobicContact CE1-CZ 3.88Å; F173-F459 HydrophobicContact CG-CE1 4.19Å; F173-F459 HydrophobicContact CG-CE2 4.43Å; F173-F459 AromaticContact CG-CZ 3.47Å; F173-F459 HydrophobicContact CG-CZ 3.47Å; F173-F459 VanDerWaalsContact CG-CZ 3.47Å; F173-F459 HydrophobicContact CZ-CZ 4.44Å; F174-F459 AromaticContact CE2-CE2 3.76Å; F174-F459 HydrophobicContact CE2-CE2 3.76Å; F174-F459 HydrophobicContact CZ-CD2 4.37Å; F174-F459 AromaticContact CZ-CE2 3.71Å; F174-F459 HydrophobicContact CZ-CE2 3.71Å; W184-F459 AromaticContact CH2-CD1 3.67Å; W184-F459 HydrophobicContact CH2-CD1 3.67Å; W184-F459 AromaticContact CH2-CE1 3.86Å; W184-F459 HydrophobicContact CH2-CE1 3.86Å; W184-F459 HydrophobicContact CZ3-CD1 4.05Å; W184-F459 AromaticContact CZ3-CE1 3.83Å; W184-F459 HydrophobicContact CZ3-CE1 3.83Å; M188-F459 HydrophobicContact CE-CD1 4.04Å; M188-F459 HydrophobicContact CE-CE1 3.69Å; L193-F459 HydrophobicContact CD2-CB 3.94Å; L193-F459 HydrophobicContact CD2-CD1 4.03Å; L193-F459 HydrophobicContact CD2-CG 4.01Å; L197-F459 HydrophobicContact CD1-CB 3.89Å; L197-F459 HydrophobicContact CD1-CD2 3.94Å; L197-F459 HydrophobicContact CD1-CG 4.27Å; A455-F459 HydrophobicContact CB-CD2 4.14Å; A455-F459 HydrophobicContact CB-CE2 4.48Å; A455-F459 WeakPolarHBondContact O-CD2 3.5Å; A455-F459 PolarHBondContact O-N 2.95Å; F459-L466 WeakPolarHBondContact O-CB 3.22Å; F459-L466 PolarHBondContact O-N 2.92Å; F459-L466 VanDerWaalsContact O-N 3.11Å
460	G	91.8	Very high	94.5	Very high	3 Å²	3	39.5 Å²	39.5	3%	0.031	18%	0.182	C	C	.	.			trans	90.9	149.9	-173	0	0	0	0	0	113.1	A456	A456-G460 CarbonylContact O-C 3.59Å; A456-G460 WeakPolarHBondContact O-CA 3.43Å; A456-G460 PolarHBondContact O-N 2.98Å
461	A	93.2	Very high	94.6	Very high	25 Å²	25	36.4 Å²	36.4	21%	0.207	17%	0.168	C	C	.	.	S	Bend	trans	-135.3	-77.3	168.8	0	0	0	0	0	107.4	V200 Y204 Q410 A456	V200-A461 HydrophobicContact CG1-CB 3.61Å; Y204-A461 WeakPolarHBondContact CD2-O 3.25Å; Q410-A461 PolarHBondContact NE2-O 3.5Å; A456-A461 HydrophobicContact CB-CB 3.88Å
462	Y	95.6	Very high	94.9	Very high	55 Å²	55	25.7 Å²	25.7	22%	0.216	13%	0.127	C	C	.	.	S	Bend	trans	-65	-52.3	175	173.9	-83.3	0	0	0	111.8	Y204 Y210 N412 P413	Y204-Y462 AromaticContact CE1-CD2 3.91Å; Y204-Y462 HydrophobicContact CE1-CD2 3.91Å; Y210-Y462 VanDerWaalsContact CE2-OH 3.3Å; Y210-Y462 WeakPolarHBondContact CE2-OH 3.36Å; Y210-Y462 VanDerWaalsContact CZ-OH 3.25Å; Y210-Y462 PolarHBondContact OH-OH 2.98Å; N412-Y462 HydrophobicContact CB-CD1 4.2Å; N412-Y462 HydrophobicContact CB-CE1 3.93Å; N412-Y462 HydrophobicContact CB-CE2 4.48Å; N412-Y462 WeakPolarHBondContact CB-O 3.25Å; N412-Y462 VanDerWaalsContact CG-O 3.32Å; N412-Y462 WeakPolarHBondContact ND2-CD2 3.4Å; N412-Y462 WeakPolarHBondContact ND2-CE2 3.36Å; N412-Y462 VanDerWaalsContact ND2-CZ 3.33Å; P413-Y462 HydrophobicContact CG-CE1 4.28Å
463	H	97.9	Very high	95.2	Very high	46 Å²	46	22 Å²	22	21%	0.213	11%	0.111	C	C	.	.	S	Bend	trans	-80.5	152.1	178.5	-60.6	-67.4	0	0	0	111.6	Q410 P413 P414 L465	Q410-H463 PolarHBondContact NE2-O 2.96Å; P413-H463 PolarHBondContact O-ND1 3.12Å; P414-H463 PolarHBondContact O-ND1 2.69Å; H463-L465 HydrophobicContact CB-CB 4.45Å; H463-L465 PolarHBondContact O-N 3.17Å
464	P	97.6	Very high	95.3	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.			trans	-71.7	39.4	170.7	33.5	-36.3	0	0	0	113.5	I401 I409 L466 Y467 E468	I401-P464 HydrophobicContact CD1-CG 4.29Å; I409-P464 HydrophobicContact CB-CB 4.07Å; I409-P464 HydrophobicContact CD1-CB 4.03Å; I409-P464 HydrophobicContact CD1-CG 4.28Å; I409-P464 HydrophobicContact CG1-CB 4.32Å; P464-L466 VanDerWaalsContact C-N 3.34Å; P464-L466 PolarHBondContact O-N 3.19Å; P464-Y467 HydrophobicContact CB-CD2 3.89Å; P464-Y467 WeakPolarHBondContact O-CA 3.39Å; P464-Y467 WeakPolarHBondContact O-CB 3.18Å; P464-Y467 PolarHBondContact O-N 3.38Å; P464-E468 HydrophobicContact CG-CG 4.47Å; P464-E468 WeakPolarHBondContact O-CG 3.28Å; P464-E468 PolarHBondContact O-N 3.08Å
465	L	97.9	Very high	95.6	Very high	21 Å²	21	15.1 Å²	15.1	11%	0.11	8%	0.082	C	C	.	.	H	α-helix	trans	-59.1	-36.3	-167.8	-175.1	63.5	0	0	0	114	F436 C457 H463 Y467 E468 K469	F436-L465 HydrophobicContact CE2-CD1 3.83Å; F436-L465 HydrophobicContact CZ-CD1 3.81Å; C457-L465 WeakPolarHBondContact O-CD2 2.99Å; H463-L465 HydrophobicContact CB-CB 4.45Å; H463-L465 PolarHBondContact O-N 3.17Å; L465-Y467 VanDerWaalsContact C-N 3.29Å; L465-Y467 PolarHBondContact O-N 2.83Å; L465-E468 WeakPolarHBondContact O-CB 3.2Å; L465-E468 PolarHBondContact O-N 2.82Å; L465-K469 WeakPolarHBondContact O-CG 3.12Å; L465-K469 PolarHBondContact O-N 2.88Å
466	L	96.8	Very high	95.9	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.016	8%	0.083	C	C	.	.	H	α-helix	trans	-56.3	-46.2	172.9	175.4	150.8	0	0	0	111.1	W184 M188 L193 F459 P464 K469 N470	W184-L466 HydrophobicContact CZ2-CG 4.16Å; M188-L466 HydrophobicContact CB-CD1 4.32Å; M188-L466 HydrophobicContact CB-CD2 4.12Å; M188-L466 HydrophobicContact CB-CG 4.16Å; M188-L466 HydrophobicContact CE-CD1 4.03Å; M188-L466 WeakPolarHBondContact O-CD2 3.43Å; L193-L466 HydrophobicContact CD1-CD1 4.19Å; L193-L466 HydrophobicContact CD2-CD1 3.67Å; L193-L466 HydrophobicContact CG-CD1 3.98Å; F459-L466 WeakPolarHBondContact O-CB 3.22Å; F459-L466 PolarHBondContact O-N 2.92Å; F459-L466 VanDerWaalsContact O-N 3.11Å; P464-L466 VanDerWaalsContact C-N 3.34Å; P464-L466 PolarHBondContact O-N 3.19Å; L466-K469 PolarHBondContact O-N 3.4Å; L466-N470 PolarHBondContact O-N 3.31Å; L466-N470 VanDerWaalsContact O-N 3.15Å; L466-N470 PolarHBondContact O-OD1 3.45Å
467	Y	97.2	Very high	96.3	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-73.8	-33.3	-179	-51	-69.8	0	0	0	111.9	M405 E407 I409 Q410 P464 L465 K469 N470 L471	M405-Y467 HydrophobicContact CG-CD1 3.78Å; M405-Y467 HydrophobicContact CG-CG 4.1Å; M405-Y467 HydrophobicContact SD-CD1 3.5Å; M405-Y467 VanDerWaalsContact SD-CD1 3.5Å; M405-Y467 HydrophobicContact SD-CE1 4.43Å; M405-Y467 HydrophobicContact SD-CG 4.14Å; E407-Y467 VanDerWaalsContact CD-OH 3.23Å; E407-Y467 HydrophobicContact CG-CE1 4Å; E407-Y467 WeakPolarHBondContact OE1-CE1 3.44Å; E407-Y467 VanDerWaalsContact OE1-CZ 3.28Å; E407-Y467 PolarHBondContact OE1-OH 2.98Å; I409-Y467 HydrophobicContact CB-CD2 3.78Å; I409-Y467 HydrophobicContact CB-CE2 3.95Å; I409-Y467 HydrophobicContact CB-CG 4.41Å; I409-Y467 HydrophobicContact CG2-CD1 4.05Å; I409-Y467 HydrophobicContact CG2-CD2 3.44Å; I409-Y467 VanDerWaalsContact CG2-CD2 3.44Å; I409-Y467 HydrophobicContact CG2-CE1 4.29Å; I409-Y467 HydrophobicContact CG2-CE2 3.73Å; I409-Y467 HydrophobicContact CG2-CG 3.6Å; Q410-Y467 VanDerWaalsContact OE1-CE2 3.29Å; P464-Y467 HydrophobicContact CB-CD2 3.89Å; P464-Y467 WeakPolarHBondContact O-CA 3.39Å; P464-Y467 WeakPolarHBondContact O-CB 3.18Å; P464-Y467 PolarHBondContact O-N 3.38Å; L465-Y467 VanDerWaalsContact C-N 3.29Å; L465-Y467 PolarHBondContact O-N 2.83Å; Y467-K469 VanDerWaalsContact C-N 3.3Å; Y467-K469 PolarHBondContact O-N 2.85Å; Y467-N470 WeakPolarHBondContact O-CB 3.49Å; Y467-N470 PolarHBondContact O-N 2.92Å; Y467-L471 WeakPolarHBondContact O-CD1 3.3Å; Y467-L471 PolarHBondContact O-N 2.9Å; Y467-L471 VanDerWaalsContact O-N 3.12Å
468	E	98.6	Very high	96.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59	-43.2	170.7	-61	172.2	-149.5	0	0	111.2	I401 P414 S415 L418 F436 P464 L465 N470 L471 V472	I401-E468 HydrophobicContact CD1-CG 3.79Å; P414-E468 WeakPolarHBondContact CA-OE1 3.42Å; S415-E468 VanDerWaalsContact CB-OE2 3.23Å; S415-E468 WeakPolarHBondContact CB-OE2 3.44Å; S415-E468 PolarHBondContact N-OE1 3.42Å; S415-E468 PolarHBondContact N-OE2 3.31Å; S415-E468 PolarHBondContact OG-OE2 3.37Å; L418-E468 HydrophobicContact CB-CB 4.4Å; L418-E468 HydrophobicContact CB-CG 4.29Å; L418-E468 VanDerWaalsContact CB-OE2 3.3Å; L418-E468 WeakPolarHBondContact CB-OE2 3.4Å; L418-E468 HydrophobicContact CD2-CB 3.93Å; L418-E468 HydrophobicContact CD2-CG 3.67Å; F436-E468 HydrophobicContact CE1-CB 4.42Å; F436-E468 HydrophobicContact CZ-CB 3.95Å; P464-E468 HydrophobicContact CG-CG 4.47Å; P464-E468 WeakPolarHBondContact O-CG 3.28Å; P464-E468 PolarHBondContact O-N 3.08Å; L465-E468 WeakPolarHBondContact O-CB 3.2Å; L465-E468 PolarHBondContact O-N 2.82Å; E468-N470 VanDerWaalsContact C-N 3.34Å; E468-N470 PolarHBondContact O-N 3.26Å; E468-L471 WeakPolarHBondContact O-CB 3.45Å; E468-L471 PolarHBondContact O-N 3.2Å; E468-V472 WeakPolarHBondContact O-CG2 3.43Å; E468-V472 PolarHBondContact O-N 3.45Å
469	K	98.4	Very high	96.8	Very high	9 Å²	9	22 Å²	22	4%	0.039	12%	0.116	C	C	.	.	H	α-helix	trans	-65.7	-35.4	176.6	-70.6	-179.7	-177.9	-158	0	112.7	W184 F436 L437 T458 L465 L466 Y467 V472 K473	W184-K469 HydrophobicContact CD2-CB 4.01Å; W184-K469 HydrophobicContact CD2-CD 4.19Å; W184-K469 VanDerWaalsContact CE2-CB 3.42Å; W184-K469 HydrophobicContact CE3-CD 4.03Å; W184-K469 HydrophobicContact CG-CB 4.43Å; W184-K469 HydrophobicContact CH2-CB 4.28Å; W184-K469 HydrophobicContact CH2-CD 3.54Å; W184-K469 HydrophobicContact CZ2-CB 3.57Å; W184-K469 HydrophobicContact CZ2-CD 3.73Å; W184-K469 HydrophobicContact CZ2-CG 4.27Å; W184-K469 HydrophobicContact CZ3-CD 3.71Å; F436-K469 HydrophobicContact CD1-CG 3.98Å; F436-K469 HydrophobicContact CE1-CB 4.39Å; F436-K469 HydrophobicContact CE1-CG 3.6Å; F436-K469 HydrophobicContact CZ-CG 4.24Å; F436-K469 WeakPolarHBondContact O-CE 3.24Å; F436-K469 PolarHBondContact O-NZ 3.4Å; L437-K469 HydrophobicContact CD2-CB 3.62Å; L437-K469 HydrophobicContact CD2-CD 4.39Å; L437-K469 HydrophobicContact CD2-CG 3.85Å; T458-K469 WeakPolarHBondContact O-CE 3.47Å; T458-K469 PolarHBondContact O-NZ 3.42Å; L465-K469 WeakPolarHBondContact O-CG 3.12Å; L465-K469 PolarHBondContact O-N 2.88Å; L466-K469 PolarHBondContact O-N 3.4Å; Y467-K469 VanDerWaalsContact C-N 3.3Å; Y467-K469 PolarHBondContact O-N 2.85Å; K469-V472 PolarHBondContact O-N 3.31Å; K469-K473 VanDerWaalsContact O-CB 3.32Å; K469-K473 WeakPolarHBondContact O-CB 3.28Å; K469-K473 PolarHBondContact O-N 2.95Å
470	N	97.4	Very high	97	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.011	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-46.3	172.3	-66.2	-5.8	0	0	0	111.2	W184 N185 D186 M188 M405 L466 Y467 E468 K473 R474	W184-N470 PolarHBondContact NE1-OD1 3Å; N185-N470 PolarHBondContact O-OD1 3.14Å; D186-N470 HydrophobicContact CB-CB 4.36Å; D186-N470 WeakPolarHBondContact O-CB 3.3Å; D186-N470 VanDerWaalsContact O-CG 3.3Å; D186-N470 PolarHBondContact O-ND2 2.88Å; M188-N470 PolarHBondContact O-ND2 3.32Å; M405-N470 HydrophobicContact CE-CB 4.02Å; L466-N470 PolarHBondContact O-N 3.31Å; L466-N470 VanDerWaalsContact O-N 3.15Å; L466-N470 PolarHBondContact O-OD1 3.45Å; Y467-N470 WeakPolarHBondContact O-CB 3.49Å; Y467-N470 PolarHBondContact O-N 2.92Å; E468-N470 VanDerWaalsContact C-N 3.34Å; E468-N470 PolarHBondContact O-N 3.26Å; N470-K473 PolarHBondContact O-N 2.97Å; N470-R474 WeakPolarHBondContact O-CB 3.38Å; N470-R474 PolarHBondContact O-N 3.09Å; N470-R474 VanDerWaalsContact O-N 3.07Å
471	L	97.5	Very high	97.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-50.1	175.3	-94	65.2	0	0	0	111.2	L231 I401 N404 M405 Y467 E468 K473 R474 M475	L231-L471 HydrophobicContact CD1-CD2 4.23Å; L231-L471 HydrophobicContact CD1-CG 4.35Å; L231-L471 HydrophobicContact CD2-CB 4.17Å; L231-L471 HydrophobicContact CD2-CD2 4.39Å; L231-L471 HydrophobicContact CD2-CG 3.73Å; I401-L471 HydrophobicContact CB-CD2 4.36Å; I401-L471 HydrophobicContact CG1-CD2 3.8Å; I401-L471 HydrophobicContact CG2-CD1 4.4Å; N404-L471 HydrophobicContact CB-CD1 4.24Å; M405-L471 HydrophobicContact CE-CD1 3.03Å; Y467-L471 WeakPolarHBondContact O-CD1 3.3Å; Y467-L471 PolarHBondContact O-N 2.9Å; Y467-L471 VanDerWaalsContact O-N 3.12Å; E468-L471 WeakPolarHBondContact O-CB 3.45Å; E468-L471 PolarHBondContact O-N 3.2Å; L471-K473 VanDerWaalsContact C-N 3.32Å; L471-K473 PolarHBondContact O-N 3.4Å; L471-R474 WeakPolarHBondContact O-CB 3.32Å; L471-R474 PolarHBondContact O-N 2.92Å; L471-R474 VanDerWaalsContact O-N 3.1Å; L471-M475 HydrophobicContact CB-CE 4.32Å; L471-M475 VanDerWaalsContact O-CG 3.31Å; L471-M475 WeakPolarHBondContact O-CG 3.47Å; L471-M475 PolarHBondContact O-N 2.82Å
472	V	98.5	Very high	97.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-40.4	-178.4	172	0	0	0	0	111.9	L418 F436 L437 E468 K469 R474 M475 N476 V489	L418-V472 HydrophobicContact CD1-CG2 3.7Å; F436-V472 HydrophobicContact CD1-CB 4.1Å; F436-V472 HydrophobicContact CD1-CG1 4.01Å; F436-V472 HydrophobicContact CD1-CG2 3.96Å; F436-V472 HydrophobicContact CE1-CB 4Å; F436-V472 HydrophobicContact CE1-CG1 4.41Å; F436-V472 HydrophobicContact CE1-CG2 3.58Å; F436-V472 HydrophobicContact CZ-CG2 4.42Å; L437-V472 HydrophobicContact CD1-CG1 4.36Å; L437-V472 HydrophobicContact CD2-CG1 4.45Å; L437-V472 HydrophobicContact CG-CG1 4.16Å; E468-V472 WeakPolarHBondContact O-CG2 3.43Å; E468-V472 PolarHBondContact O-N 3.45Å; K469-V472 PolarHBondContact O-N 3.31Å; V472-R474 VanDerWaalsContact C-N 3.32Å; V472-R474 PolarHBondContact O-N 2.9Å; V472-M475 HydrophobicContact CG2-CE 4.25Å; V472-M475 PolarHBondContact O-N 3.49Å; V472-N476 PolarHBondContact O-N 3.43Å; V472-N476 VanDerWaalsContact O-N 3.11Å; V472-V489 HydrophobicContact CG1-CB 4.31Å; V472-V489 HydrophobicContact CG1-CG1 3.79Å; V472-V489 HydrophobicContact CG1-CG2 4.07Å
473	K	97.9	Very high	97.5	Very high	30 Å²	30	32.1 Å²	32.1	13%	0.13	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-40.9	174.7	176	61.6	179.5	-174.9	0	111.7	V183 W184 D186 L437 K469 N470 L471 N476 D480 I483	V183-K473 HydrophobicContact CG1-CD 4.45Å; W184-K473 VanDerWaalsContact O-CE 3.26Å; W184-K473 WeakPolarHBondContact O-CE 3.16Å; D186-K473 HydrophobicContact CB-CB 3.99Å; D186-K473 HydrophobicContact CB-CG 3.81Å; L437-K473 HydrophobicContact CD1-CB 3.75Å; L437-K473 HydrophobicContact CD1-CD 4Å; L437-K473 HydrophobicContact CD1-CG 4.43Å; K469-K473 VanDerWaalsContact O-CB 3.32Å; K469-K473 WeakPolarHBondContact O-CB 3.28Å; K469-K473 PolarHBondContact O-N 2.95Å; N470-K473 PolarHBondContact O-N 2.97Å; L471-K473 VanDerWaalsContact C-N 3.32Å; L471-K473 PolarHBondContact O-N 3.4Å; K473-N476 VanDerWaalsContact O-CB 3.31Å; K473-N476 WeakPolarHBondContact O-CB 3.22Å; K473-N476 PolarHBondContact O-N 2.87Å; K473-D480 IonicContact NZ-OD1 2.81Å; K473-D480 PolarHBondContact NZ-OD1 3.35Å; K473-D480 IonicContact NZ-OD2 3.89Å; K473-D480 PolarHBondContact NZ-OD2 3.08Å; K473-I483 HydrophobicContact CD-CD1 3.94Å
474	R	97.1	Very high	97.4	Very high	33 Å²	33	32.5 Å²	32.5	13%	0.125	16%	0.156	C	C	.	.	H	α-helix	trans	-70.6	-34.8	180	-165.7	175.2	-51.6	121.8	15.7	113.6	D186 L226 G228 N470 L471 V472 N476	D186-R474 PolarHBondContact O-NH2 3.13Å; D186-R474 IonicContact OD2-CZ 3.47Å; D186-R474 IonicContact OD2-NE 2.92Å; D186-R474 PolarHBondContact OD2-NE 3.11Å; D186-R474 IonicContact OD2-NH2 3.47Å; D186-R474 PolarHBondContact OD2-NH2 2.75Å; L226-R474 WeakPolarHBondContact O-CD 3.49Å; G228-R474 VanDerWaalsContact CA-O 3.27Å; G228-R474 WeakPolarHBondContact CA-O 3.41Å; N470-R474 WeakPolarHBondContact O-CB 3.38Å; N470-R474 PolarHBondContact O-N 3.09Å; N470-R474 VanDerWaalsContact O-N 3.07Å; L471-R474 WeakPolarHBondContact O-CB 3.32Å; L471-R474 PolarHBondContact O-N 2.92Å; L471-R474 VanDerWaalsContact O-N 3.1Å; V472-R474 VanDerWaalsContact C-N 3.32Å; V472-R474 PolarHBondContact O-N 2.9Å; R474-N476 VanDerWaalsContact C-N 3.32Å
475	M	97.6	Very high	97.3	Very high	3 Å²	3	34 Å²	34	2%	0.015	17%	0.165	C	C	.	.	H	α-helix	trans	-80.5	-12.7	177.5	-64.3	-174.7	-62.8	0	0	113.5	L231 L232 L235 L471 V472 Q477 L491	L231-M475 HydrophobicContact CB-CG 4.5Å; L231-M475 HydrophobicContact CD2-CG 3.48Å; L231-M475 VanDerWaalsContact CD2-CG 3.48Å; L231-M475 HydrophobicContact CD2-SD 3.89Å; L231-M475 HydrophobicContact CG-CG 3.92Å; L231-M475 HydrophobicContact CG-SD 3.94Å; L232-M475 HydrophobicContact CD1-CB 4.41Å; L232-M475 HydrophobicContact CD2-CB 4.01Å; L232-M475 HydrophobicContact CD2-CG 4.04Å; L232-M475 HydrophobicContact CD2-SD 3.72Å; L232-M475 HydrophobicContact CG-CB 4.05Å; L232-M475 HydrophobicContact CG-CG 3.93Å; L232-M475 HydrophobicContact CG-SD 4.12Å; L235-M475 HydrophobicContact CD1-CE 4.03Å; L235-M475 HydrophobicContact CD1-SD 3.23Å; L235-M475 WeakPolarHBondContact CD1-SD 3.34Å; L471-M475 HydrophobicContact CB-CE 4.32Å; L471-M475 VanDerWaalsContact O-CG 3.31Å; L471-M475 WeakPolarHBondContact O-CG 3.47Å; L471-M475 PolarHBondContact O-N 2.82Å; V472-M475 HydrophobicContact CG2-CE 4.25Å; V472-M475 PolarHBondContact O-N 3.49Å; M475-Q477 PolarHBondContact O-N 3.43Å; M475-L491 HydrophobicContact CB-CD2 3.63Å; M475-L491 WeakPolarHBondContact O-CD2 3.35Å
476	N	98.4	Very high	97.3	Very high	25 Å²	25	36 Å²	36	13%	0.134	17%	0.173	C	C	.	.			trans	-60	128.5	-176.2	-178.2	42.6	0	0	0	111.9	V472 K473 R474 G478 V489 T490	V472-N476 PolarHBondContact O-N 3.43Å; V472-N476 VanDerWaalsContact O-N 3.11Å; K473-N476 VanDerWaalsContact O-CB 3.31Å; K473-N476 WeakPolarHBondContact O-CB 3.22Å; K473-N476 PolarHBondContact O-N 2.87Å; R474-N476 VanDerWaalsContact C-N 3.32Å; N476-G478 PolarHBondContact ND2-O 2.84Å; N476-G478 PolarHBondContact OD1-N 3.21Å; N476-V489 HydrophobicContact CB-CG1 3.79Å; N476-V489 WeakPolarHBondContact OD1-CA 3.28Å; N476-V489 VanDerWaalsContact OD1-CG1 3.25Å; N476-V489 WeakPolarHBondContact OD1-CG1 3.41Å; N476-T490 PolarHBondContact OD1-N 3.04Å; N476-T490 PolarHBondContact OD1-O 3.27Å
477	Q	97.8	Very high	97.3	Very high	128 Å²	128	35.9 Å²	35.9	60%	0.598	17%	0.173	S	C	*	.			trans	-99.3	-8.9	171.6	-64.2	-177.6	-22.1	0	0	112.8	M475 T490	M475-Q477 PolarHBondContact O-N 3.43Å; Q477-T490 PolarHBondContact N-O 2.78Å
478	G	97.3	Very high	97.4	Very high	20 Å²	20	38.1 Å²	38.1	21%	0.206	18%	0.181	C	C	.	.	S	Bend	trans	-80.1	175.3	175.6	0	0	0	0	0	113.2	N476	N476-G478 PolarHBondContact ND2-O 2.84Å; N476-G478 PolarHBondContact OD1-N 3.21Å
479	S	96.9	Very high	97.4	Very high	52 Å²	52	38.1 Å²	38.1	36%	0.364	18%	0.181	S	C	.	.			trans	-85.3	155.5	-179.6	73.7	0	0	0	0	112.9	R481 D482 I483	S479-R481 PolarHBondContact O-N 3.27Å; S479-R481 PolarHBondContact OG-N 3.06Å; S479-D482 PolarHBondContact N-OD2 3.44Å; S479-D482 VanDerWaalsContact N-OD2 3.17Å; S479-D482 WeakPolarHBondContact O-CB 3.4Å; S479-D482 PolarHBondContact O-N 2.96Å; S479-D482 VanDerWaalsContact OG-CG 3.26Å; S479-D482 PolarHBondContact OG-N 3.43Å; S479-D482 VanDerWaalsContact OG-N 3.12Å; S479-D482 PolarHBondContact OG-OD2 3.45Å; S479-I483 PolarHBondContact O-N 2.87Å
480	D	95.9	Very high	97.4	Very high	82 Å²	82	38.8 Å²	38.8	44%	0.439	19%	0.186	S	C	.	.	H	α-helix	trans	-61.1	-26.8	170.8	-81.1	20.4	0	0	0	112.2	V183 K473 D482 I483 Y484	V183-D480 HydrophobicContact CG2-CB 4.08Å; V183-D480 WeakPolarHBondContact CG2-O 3.45Å; K473-D480 IonicContact NZ-OD1 2.81Å; K473-D480 PolarHBondContact NZ-OD1 3.35Å; K473-D480 IonicContact NZ-OD2 3.89Å; K473-D480 PolarHBondContact NZ-OD2 3.08Å; D480-D482 VanDerWaalsContact C-N 3.33Å; D480-I483 PolarHBondContact O-N 3.36Å; D480-Y484 WeakPolarHBondContact O-CB 3.36Å; D480-Y484 PolarHBondContact O-N 3.06Å
481	R	95.6	Very high	97.5	Very high	183 Å²	183	38.7 Å²	38.7	69%	0.691	19%	0.185	S	C	*	.	H	α-helix	trans	-66.7	-33.7	173.4	-172.3	175.4	179.1	176.9	0.1	112.3	S479 N485	S479-R481 PolarHBondContact O-N 3.27Å; S479-R481 PolarHBondContact OG-N 3.06Å; R481-N485 WeakPolarHBondContact CG-ND2 3.47Å; R481-N485 WeakPolarHBondContact O-CB 3.49Å; R481-N485 PolarHBondContact O-N 3.28Å; R481-N485 PolarHBondContact O-ND2 3.44Å
482	D	97.7	Very high	97.5	Very high	33 Å²	33	39.1 Å²	39.1	18%	0.176	19%	0.188	C	C	.	.	H	α-helix	trans	-68.4	-42.8	174.5	-67.9	-58.5	0	0	0	111.2	S479 D480 H486 G487 R488	S479-D482 PolarHBondContact N-OD2 3.44Å; S479-D482 VanDerWaalsContact N-OD2 3.17Å; S479-D482 WeakPolarHBondContact O-CB 3.4Å; S479-D482 PolarHBondContact O-N 2.96Å; S479-D482 VanDerWaalsContact OG-CG 3.26Å; S479-D482 PolarHBondContact OG-N 3.43Å; S479-D482 VanDerWaalsContact OG-N 3.12Å; S479-D482 PolarHBondContact OG-OD2 3.45Å; D480-D482 VanDerWaalsContact C-N 3.33Å; D482-H486 CarbonylContact O-C 3.51Å; D482-H486 WeakPolarHBondContact O-CA 3.47Å; D482-H486 WeakPolarHBondContact O-CB 3.42Å; D482-H486 PolarHBondContact O-N 3.44Å; D482-H486 IonicContact OD1-ND1 3.82Å; D482-G487 PolarHBondContact O-N 3.31Å; D482-R488 PolarHBondContact O-N 2.95Å; D482-R488 IonicContact OD1-CZ 3.79Å; D482-R488 IonicContact OD1-NH2 3.99Å; D482-R488 PolarHBondContact OD1-NH2 3.1Å
483	I	97.7	Very high	97.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-48.6	175.5	-55.6	166.6	0	0	0	109.6	V183 L437 S439 K473 S479 D480 N485 G487 R488 V489	V183-I483 HydrophobicContact CG1-CB 3.67Å; V183-I483 HydrophobicContact CG1-CD1 3.64Å; V183-I483 HydrophobicContact CG1-CG1 4.26Å; V183-I483 HydrophobicContact CG1-CG2 3.5Å; V183-I483 HydrophobicContact CG2-CB 4.41Å; L437-I483 HydrophobicContact CB-CG2 3.78Å; L437-I483 HydrophobicContact CD1-CD1 3.9Å; S439-I483 VanDerWaalsContact CA-O 3.29Å; S439-I483 WeakPolarHBondContact CA-O 3.46Å; S439-I483 WeakPolarHBondContact CB-O 3.38Å; K473-I483 HydrophobicContact CD-CD1 3.94Å; S479-I483 PolarHBondContact O-N 2.87Å; D480-I483 PolarHBondContact O-N 3.36Å; I483-N485 PolarHBondContact O-N 3.46Å; I483-G487 WeakPolarHBondContact O-CA 3.34Å; I483-G487 PolarHBondContact O-N 3.11Å; I483-R488 WeakPolarHBondContact CG1-O 3.37Å; I483-V489 HydrophobicContact CG1-CG2 4.25Å
484	Y	95.9	Very high	97.4	Very high	53 Å²	53	38.7 Å²	38.7	21%	0.208	19%	0.186	C	C	.	.	H	α-helix	trans	-60	-45.7	-178.4	-178.6	-108.3	0	0	0	113.3	L180 G181 S439 R440 D480	L180-Y484 WeakPolarHBondContact O-CD2 3.31Å; L180-Y484 WeakPolarHBondContact O-CE2 3.43Å; G181-Y484 WeakPolarHBondContact O-CD2 3.33Å; G181-Y484 WeakPolarHBondContact O-CE2 3.24Å; S439-Y484 WeakPolarHBondContact CB-O 3.43Å; R440-Y484 HydrophobicContact CB-CD2 3.91Å; R440-Y484 HydrophobicContact CB-CE1 4.18Å; R440-Y484 HydrophobicContact CB-CE2 3.44Å; R440-Y484 VanDerWaalsContact CB-CE2 3.44Å; R440-Y484 HydrophobicContact CB-CG 4.47Å; R440-Y484 WeakPolarHBondContact CB-O 3.39Å; R440-Y484 WeakPolarHBondContact CG-O 3.42Å; R440-Y484 PolarHBondContact N-O 2.83Å; D480-Y484 WeakPolarHBondContact O-CB 3.36Å; D480-Y484 PolarHBondContact O-N 3.06Å
485	N	95.4	Very high	97.2	Very high	33 Å²	33	41.1 Å²	41.1	18%	0.176	21%	0.208	C	C	.	.	H	α-helix	trans	-86.9	-39	-174.5	-67.9	-57.3	0	0	0	113.3	R440 R441 R481 I483	R440-N485 PolarHBondContact NH1-OD1 2.98Å; R441-N485 PolarHBondContact NH1-O 2.84Å; R441-N485 PolarHBondContact NH2-O 3.23Å; R481-N485 WeakPolarHBondContact CG-ND2 3.47Å; R481-N485 WeakPolarHBondContact O-CB 3.49Å; R481-N485 PolarHBondContact O-N 3.28Å; R481-N485 PolarHBondContact O-ND2 3.44Å; I483-N485 PolarHBondContact O-N 3.46Å
486	H	97.4	Very high	96.9	Very high	63 Å²	63	44.1 Å²	44.1	29%	0.292	23%	0.234	S	C	.	.	H	α-helix	trans	-115	-11.1	-170.1	-52.8	112.3	0	0	0	112.9	L290 R441 D482 R488	L290-H486 WeakPolarHBondContact CD1-O 2.98Å; L290-H486 HydrophobicContact CD2-CB 3.99Å; R441-H486 PolarHBondContact NH2-O 3.47Å; D482-H486 CarbonylContact O-C 3.51Å; D482-H486 WeakPolarHBondContact O-CA 3.47Å; D482-H486 WeakPolarHBondContact O-CB 3.42Å; D482-H486 PolarHBondContact O-N 3.44Å; D482-H486 IonicContact OD1-ND1 3.82Å; H486-R488 HydrophobicContact CB-CB 3.84Å; H486-R488 PolarHBondContact O-N 2.86Å
487	G	98	Very high	96.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.233	C	C	.	.			trans	63.2	24.6	-171.2	0	0	0	0	0	111	Y434 E435 D482 I483	Y434-G487 CarbonylContact C-O 3.57Å; Y434-G487 WeakPolarHBondContact CA-O 3.32Å; E435-G487 PolarHBondContact N-O 3.35Å; D482-G487 PolarHBondContact O-N 3.31Å; I483-G487 WeakPolarHBondContact O-CA 3.34Å; I483-G487 PolarHBondContact O-N 3.11Å
488	R	98.6	Very high	96.4	Very high	51 Å²	51	42.7 Å²	42.7	19%	0.192	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126	-170.4	-174	-179.1	69.7	-174.3	1.9	110.3	E293 H432 V433 Y434 D482 I483 H486	E293-R488 VanDerWaalsContact OE1-CD 3.24Å; E293-R488 WeakPolarHBondContact OE1-CD 3.35Å; E293-R488 IonicContact OE1-CZ 3.63Å; E293-R488 IonicContact OE1-NE 3.48Å; E293-R488 IonicContact OE1-NH1 2.71Å; E293-R488 PolarHBondContact OE1-NH1 3.44Å; E293-R488 IonicContact OE2-NH1 3.77Å; H432-R488 HydrophobicContact CB-CG 4.18Å; V433-R488 WeakPolarHBondContact O-CA 3.36Å; Y434-R488 HydrophobicContact CD1-CB 4.16Å; Y434-R488 HydrophobicContact CD1-CG 4.22Å; Y434-R488 HydrophobicContact CE1-CB 4.05Å; Y434-R488 HydrophobicContact CE1-CG 3.79Å; D482-R488 PolarHBondContact O-N 2.95Å; D482-R488 IonicContact OD1-CZ 3.79Å; D482-R488 IonicContact OD1-NH2 3.99Å; D482-R488 PolarHBondContact OD1-NH2 3.1Å; I483-R488 WeakPolarHBondContact CG1-O 3.37Å; H486-R488 HydrophobicContact CB-CB 3.84Å; H486-R488 PolarHBondContact O-N 2.86Å
489	V	98.5	Very high	96.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.5	170	175.9	0	0	0	0	108.3	H432 V433 L437 V472 N476 I483 L491	H432-V489 CarbonylContact C-O 3.49Å; H432-V489 VanDerWaalsContact CA-O 3.26Å; H432-V489 WeakPolarHBondContact CA-O 3.45Å; V433-V489 HydrophobicContact CB-CB 4.28Å; V433-V489 PolarHBondContact N-O 3.49Å; V433-V489 PolarHBondContact O-N 3.07Å; L437-V489 HydrophobicContact CB-CG2 3.98Å; L437-V489 HydrophobicContact CD1-CG2 3.48Å; L437-V489 VanDerWaalsContact CD1-CG2 3.48Å; L437-V489 HydrophobicContact CG-CG2 3.65Å; V472-V489 HydrophobicContact CG1-CB 4.31Å; V472-V489 HydrophobicContact CG1-CG1 3.79Å; V472-V489 HydrophobicContact CG1-CG2 4.07Å; N476-V489 HydrophobicContact CB-CG1 3.79Å; N476-V489 WeakPolarHBondContact OD1-CA 3.28Å; N476-V489 VanDerWaalsContact OD1-CG1 3.25Å; N476-V489 WeakPolarHBondContact OD1-CG1 3.41Å; I483-V489 HydrophobicContact CG1-CG2 4.25Å; V489-L491 HydrophobicContact CG1-CD2 3.88Å; V489-L491 HydrophobicContact CG1-CG 3.91Å
490	T	98.8	Very high	94.9	Very high	22 Å²	22	46.2 Å²	46.2	14%	0.135	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	121.5	173.8	-56.8	0	0	0	0	109.1	V430 H432 N476 Q477	V430-T490 HydrophobicContact CG2-CG2 3.6Å; H432-T490 PolarHBondContact CD2-OG1 3.23Å; H432-T490 PolarHBondContact NE2-OG1 3.28Å; N476-T490 PolarHBondContact OD1-N 3.04Å; N476-T490 PolarHBondContact OD1-O 3.27Å; Q477-T490 PolarHBondContact N-O 2.78Å
491	L	98.8	Very high	92.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.4	178.3	-60.3	175.6	0	0	0	110	T421 M425 V431 V433 M475 V489	T421-L491 HydrophobicContact CG2-CD1 3.45Å; T421-L491 VanDerWaalsContact CG2-CD1 3.45Å; M425-L491 HydrophobicContact CE-CB 4.43Å; M425-L491 HydrophobicContact CG-CB 4.47Å; M425-L491 HydrophobicContact SD-CB 4.26Å; M425-L491 HydrophobicContact SD-CD1 3.98Å; V431-L491 HydrophobicContact CB-CB 4.48Å; V431-L491 PolarHBondContact N-O 3.08Å; V431-L491 PolarHBondContact O-N 2.87Å; V433-L491 HydrophobicContact CG2-CD1 3.99Å; M475-L491 HydrophobicContact CB-CD2 3.63Å; M475-L491 WeakPolarHBondContact O-CD2 3.35Å; V489-L491 HydrophobicContact CG1-CD2 3.88Å; V489-L491 HydrophobicContact CG1-CG 3.91Å
492	P	98.3	Very high	90.7	Very high	11 Å²	11	43.2 Å²	43.2	7%	0.071	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	147.8	175.4	33	-35.8	0	0	0	111.1	L232 M425 M497	L232-P492 HydrophobicContact CD1-CG 3.8Å; L232-P492 HydrophobicContact CD2-CG 4.13Å; M425-P492 VanDerWaalsContact CE-O 3.23Å; M425-P492 WeakPolarHBondContact CE-O 3.32Å; P492-M497 HydrophobicContact CB-CG 3.94Å; P492-M497 HydrophobicContact CB-SD 4.24Å; P492-M497 HydrophobicContact CG-CG 3.95Å; P492-M497 HydrophobicContact CG-SD 3.6Å
493	G	97.8	Very high	87.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	29%	0.286	C	S	.	.			trans	-65.9	145.6	165.2	0	0	0	0	0	113.1	M425 C428 E429 S495 A496 M497	M425-G493 CarbonylContact O-C 3.45Å; M425-G493 WeakPolarHBondContact O-CA 3.26Å; C428-G493 WeakPolarHBondContact O-CA 3.48Å; E429-G493 WeakPolarHBondContact O-CA 3.21Å; E429-G493 PolarHBondContact O-N 3Å; G493-S495 PolarHBondContact O-N 3.25Å; G493-A496 PolarHBondContact O-N 3.41Å; G493-M497 WeakPolarHBondContact O-CG 3.45Å; G493-M497 PolarHBondContact O-N 3.18Å
494	F	96.3	Very high	85.2	Confident	21 Å²	21	51.5 Å²	51.5	9%	0.092	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-60.8	-33.7	177.1	-65.6	-38.9	0	0	0	112.7	L235 K236 I422 M425 A496 M497	L235-F494 HydrophobicContact CB-CE1 4.15Å; L235-F494 HydrophobicContact CB-CZ 4.22Å; K236-F494 HydrophobicContact CB-CD1 3.74Å; K236-F494 HydrophobicContact CB-CE1 4.11Å; K236-F494 HydrophobicContact CB-CG 4.29Å; K236-F494 HydrophobicContact CD-CB 4.29Å; K236-F494 WeakPolarHBondContact CD-O 3.43Å; K236-F494 WeakPolarHBondContact CE-O 3.5Å; K236-F494 HydrophobicContact CG-CB 4.25Å; K236-F494 HydrophobicContact CG-CD1 4.29Å; K236-F494 HydrophobicContact CG-CG 4.4Å; K236-F494 PolarHBondContact NZ-O 3.16Å; I422-F494 HydrophobicContact CD1-CZ 4.44Å; I422-F494 HydrophobicContact CG2-CE2 4.04Å; I422-F494 HydrophobicContact CG2-CZ 4.11Å; M425-F494 HydrophobicContact CB-CD1 4.46Å; M425-F494 HydrophobicContact CB-CD2 4.16Å; M425-F494 HydrophobicContact CB-CE1 4.32Å; M425-F494 HydrophobicContact CB-CE2 3.98Å; M425-F494 HydrophobicContact CB-CG 4.4Å; M425-F494 HydrophobicContact CB-CZ 4.08Å; M425-F494 HydrophobicContact CE-CD1 4.15Å; M425-F494 HydrophobicContact CE-CE1 3.62Å; M425-F494 HydrophobicContact CE-CZ 4.14Å; M425-F494 PolarHBondContact O-N 3.13Å; F494-A496 VanDerWaalsContact C-N 3.31Å; F494-A496 PolarHBondContact O-N 3.48Å; F494-M497 HydrophobicContact CD1-CE 3.6Å; F494-M497 HydrophobicContact CE1-CE 4.2Å; F494-M497 PolarHBondContact O-N 3.48Å
495	S	92.4	Very high	82.3	Confident	84 Å²	84	56.6 Å²	56.6	59%	0.587	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-65.7	-32	175.2	55.4	0	0	0	0	112.9	G493	G493-S495 PolarHBondContact O-N 3.25Å
496	A	92.6	Very high	79.5	Confident	66 Å²	66	63.4 Å²	63.4	55%	0.545	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-82.8	-10.1	-179.9	0	0	0	0	0	113.5	G493 F494	G493-A496 PolarHBondContact O-N 3.41Å; F494-A496 VanDerWaalsContact C-N 3.31Å; F494-A496 PolarHBondContact O-N 3.48Å
497	M	93.6	Very high	76.4	Confident	24 Å²	24	71.7 Å²	71.7	12%	0.118	41%	0.409	C	S	.	.			trans	-91.3	137.3	-178.1	-64.4	-166.8	-38.9	0	0	113	L232 K236 P492 G493 F494	L232-M497 HydrophobicContact CB-CE 4.08Å; L232-M497 HydrophobicContact CB-SD 3.69Å; L232-M497 HydrophobicContact CD1-SD 4.24Å; L232-M497 HydrophobicContact CD2-SD 4.12Å; L232-M497 HydrophobicContact CG-SD 4.25Å; L232-M497 WeakPolarHBondContact O-CE 3.4Å; K236-M497 HydrophobicContact CB-CE 3.7Å; K236-M497 HydrophobicContact CD-CB 4.34Å; K236-M497 HydrophobicContact CD-CE 3.81Å; K236-M497 HydrophobicContact CG-CE 4.34Å; K236-M497 PolarHBondContact NZ-O 3.3Å; P492-M497 HydrophobicContact CB-CG 3.94Å; P492-M497 HydrophobicContact CB-SD 4.24Å; P492-M497 HydrophobicContact CG-CG 3.95Å; P492-M497 HydrophobicContact CG-SD 3.6Å; G493-M497 WeakPolarHBondContact O-CG 3.45Å; G493-M497 PolarHBondContact O-N 3.18Å; F494-M497 HydrophobicContact CD1-CE 3.6Å; F494-M497 HydrophobicContact CE1-CE 4.2Å; F494-M497 PolarHBondContact O-N 3.48Å
498	N	91.9	Very high	75.3	Confident	99 Å²	99	75.3 Å²	75.3	53%	0.529	43%	0.43	S	S	.	.			trans	-107.4	116.1	167.9	-168.7	6.8	0	0	0	111.8	R229 T500	R229-N498 PolarHBondContact NH2-O 3.02Å; N498-T500 PolarHBondContact ND2-OG1 3.49Å; N498-T500 WeakPolarHBondContact OD1-CB 3.28Å; N498-T500 VanDerWaalsContact OD1-CG2 3.24Å; N498-T500 WeakPolarHBondContact OD1-CG2 3.44Å; N498-T500 PolarHBondContact OD1-N 3.19Å; N498-T500 VanDerWaalsContact OD1-N 3.1Å; N498-T500 PolarHBondContact OD1-OG1 3.26Å
499	C	90.5	Very high	74.1	Confident	21 Å²	21	76.5 Å²	76.5	14%	0.142	44%	0.442	C	S	.	.			trans	-106.9	7.3	-179.4	-62.1	0	0	0	0	113.2	C233 A501	C233-C499 WeakPolarHBondContact CA-SG 3.23Å; C233-C499 HydrophobicContact CB-CB 3.78Å; C233-C499 WeakPolarHBondContact CB-SG 3.04Å; C233-C499 VanDerWaalsContact SG-CA 3.54Å; C233-C499 WeakPolarHBondContact SG-CB 3.44Å; C233-C499 CovalentContact SG-SG 2.05Å; C233-C499 PolarHBondContact SG-SG 3.46Å; C499-A501 PolarHBondContact O-N 3.4Å
500	T	71.3	Confident	72.8	Confident	125 Å²	125	80.8 Å²	80.8	77%	0.767	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	16.4	-172.5	58.5	0	0	0	0	116.2	N498	N498-T500 PolarHBondContact ND2-OG1 3.49Å; N498-T500 WeakPolarHBondContact OD1-CB 3.28Å; N498-T500 VanDerWaalsContact OD1-CG2 3.24Å; N498-T500 WeakPolarHBondContact OD1-CG2 3.44Å; N498-T500 PolarHBondContact OD1-N 3.19Å; N498-T500 VanDerWaalsContact OD1-N 3.1Å; N498-T500 PolarHBondContact OD1-OG1 3.26Å
501	A	52.6	Low	71.2	Confident	88 Å²	88	84.2 Å²	84.2	73%	0.727	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	-11.4	-175.2	0	0	0	0	0	115.4	C499	C499-A501 PolarHBondContact O-N 3.4Å
502	E	49.9	Very low	69.5	Low	113 Å²	113	89.5 Å²	89.5	53%	0.528	52%	0.517	S	S	.	.			trans	-143.2	66.8	-172.8	-70	173.7	176.1	0	0	110.5	V504	E502-V504 HydrophobicContact CB-CG2 4.26Å; E502-V504 PolarHBondContact O-N 3.42Å
503	A	40.4	Very low	67.6	Low	107 Å²	107	94.7 Å²	94.7	88%	0.884	55%	0.546	S	S	*	.			trans	-61.5	84	147.4	0	0	0	0	0	106.6	Q505	A503-Q505 PolarHBondContact O-N 3.3Å
504	V	41.3	Very low	65.4	Low	100 Å²	100	101.5 Å²	101.5	61%	0.606	59%	0.585	S	S	*	*			trans	-52.9	124.4	178.4	171.1	0	0	0	0	107.9	E502 E506	E502-V504 HydrophobicContact CB-CG2 4.26Å; E502-V504 PolarHBondContact O-N 3.42Å; V504-E506 PolarHBondContact O-N 3.45Å
505	Q	35	Very low	63	Low	160 Å²	160	107.7 Å²	107.7	75%	0.748	62%	0.623	S	S	*	*			trans	-42.1	110	162.5	-79.3	163.9	-50.4	0	0	109.2	A503 H507	A503-Q505 PolarHBondContact O-N 3.3Å; Q505-H507 PolarHBondContact O-N 2.54Å; Q505-H507 VanDerWaalsContact O-N 3.1Å
506	E	35.8	Very low	60.6	Low	176 Å²	176	109.7 Å²	109.7	82%	0.822	63%	0.626	S	S	*	*			trans	-68	102.6	161	-73.5	-171.3	151.7	0	0	107.5	V504	V504-E506 PolarHBondContact O-N 3.45Å
507	H	32.4	Very low	57.7	Low	237 Å²	237	113.6 Å²	113.6	100%	1.097	63%	0.634	S	S	*	*			trans	-118	0	162.3	-85.9	-43.7	0	0	0	110.1	Q505	Q505-H507 PolarHBondContact O-N 2.54Å; Q505-H507 VanDerWaalsContact O-N 3.1Å

Retrieved 507 of 507 residues in 84.6 ms (Link to these results)

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