A0A087YQS5_POEFO Loading...

Glucosaminyl (N-acetyl) transferase 4

AlphaFold DB , UniProt , Accession A0A087YQS5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 432 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	32.2	Very low	236 Å²	236	175.7 Å²	175.7	100%	1.163	82%	0.824	S	S	*	*				0	121.2	0	-112.5	158.7	59.6	0	0	108.2
2	N	28.8	Very low	32.5	Very low	162 Å²	162	178.7 Å²	178.7	87%	0.866	83%	0.832	S	S	*	*			trans	12.9	141.9	148.9	-71.1	-16.9	0	0	0	118.5
3	A	28.9	Very low	33	Very low	74 Å²	74	178.6 Å²	178.6	61%	0.612	83%	0.827	S	S	*	*			cis	-179.5	150.8	6.8	0	0	0	0	0	109.6
4	K	31.5	Very low	34	Very low	196 Å²	196	181.4 Å²	181.4	85%	0.852	84%	0.836	S	S	*	*			trans	60.4	124.3	139.7	-67.6	170.4	-177.5	178.5	0	117.6
5	R	32.9	Very low	35.3	Very low	245 Å²	245	178.3 Å²	178.3	93%	0.925	83%	0.827	S	S	*	*				-163.9	115.9	57.6	-128.9	165.8	-176.5	175.8	0.7	110.8
6	F	30.6	Very low	36.3	Very low	187 Å²	187	172.3 Å²	172.3	82%	0.82	81%	0.808	S	S	*	*			trans	-117.4	130	168.1	-156	-108.1	0	0	0	106.8
7	M	32.3	Very low	37.9	Very low	144 Å²	144	166.4 Å²	166.4	71%	0.709	79%	0.79	S	S	*	*			trans	66.3	143.8	164.4	-55.2	-92.5	-100.3	0	0	116.3
8	L	31.9	Very low	39.1	Very low	135 Å²	135	165.9 Å²	165.9	71%	0.707	79%	0.792	S	S	*	*			cis	-169.8	158.3	38.9	-138.4	136.6	0	0	0	108.7
9	K	31.2	Very low	40.2	Very low	176 Å²	176	164.2 Å²	164.2	77%	0.765	79%	0.787	S	S	*	*			trans	89.5	113.3	160.7	-58.8	-179.6	176	174.2	0	117.8
10	L	29.8	Very low	41.5	Very low	148 Å²	148	158.5 Å²	158.5	78%	0.775	77%	0.765	S	S	*	*				-178.4	132	91.5	-126	78.5	0	0	0	110.6
11	R	42.3	Very low	43	Very low	230 Å²	230	154.3 Å²	154.3	87%	0.868	75%	0.749	S	S	*	*			trans	14.3	115.7	147.8	-75.9	172.5	163.9	168.6	-5.2	117.3
12	K	35.7	Very low	44.8	Very low	211 Å²	211	148.1 Å²	148.1	92%	0.917	72%	0.72	S	S	*	*			trans	-124.7	106.9	144.3	-88	-176	177.2	178	0	110.3
13	K	39.2	Very low	46.9	Very low	178 Å²	178	144 Å²	144	77%	0.774	70%	0.701	S	S	*	*			trans	-49	140.5	163.2	-73.9	171.3	166.1	179.6	0	109.3	I15	K13-I15 VanDerWaalsContact C-N 3.33Å; K13-I15 HydrophobicContact CB-CG1 4.25Å; K13-I15 PolarHBondContact O-N 2.95Å
14	F	47	Very low	49.1	Very low	217 Å²	217	144.4 Å²	144.4	95%	0.952	70%	0.696	S	S	*	*			trans	-59	99.3	157.8	-99.4	-97.4	0	0	0	107.8
15	I	53.4	Low	51.2	Low	136 Å²	136	139.1 Å²	139.1	70%	0.697	68%	0.676	S	S	*	*			trans	-101.7	106.6	163.2	-59.3	175.3	0	0	0	103.9	K13 S17	K13-I15 VanDerWaalsContact C-N 3.33Å; K13-I15 HydrophobicContact CB-CG1 4.25Å; K13-I15 PolarHBondContact O-N 2.95Å; I15-S17 PolarHBondContact O-N 3.29Å
16	P	51.2	Low	53.2	Low	81 Å²	81	131.8 Å²	131.8	53%	0.526	65%	0.654	S	S	.	*			trans	-58.6	126.9	170.4	24.6	-30	0	0	0	107.1	L18 V21	P16-L18 PolarHBondContact O-N 3.46Å; P16-V21 HydrophobicContact CB-CG2 4.23Å; P16-V21 HydrophobicContact CG-CG2 4.35Å
17	S	64.1	Low	55.2	Low	72 Å²	72	128.6 Å²	128.6	50%	0.503	65%	0.645	S	S	.	*			trans	-60.2	142.7	179.3	80.6	0	0	0	0	108.4	I15 L19 S20 V21	I15-S17 PolarHBondContact O-N 3.29Å; S17-L19 PolarHBondContact O-N 2.76Å; S17-S20 PolarHBondContact N-OG 3.43Å; S17-S20 PolarHBondContact O-N 3.21Å; S17-S20 PolarHBondContact O-OG 3.48Å; S17-S20 PolarHBondContact OG-N 2.69Å; S17-V21 PolarHBondContact O-N 3.37Å
18	L	59.4	Low	57	Low	159 Å²	159	126.9 Å²	126.9	83%	0.832	64%	0.638	S	S	*	*	H	α-helix	trans	-49.6	-32.2	178.6	-118.2	89.3	0	0	0	112.1	P16 V21 L22	P16-L18 PolarHBondContact O-N 3.46Å; L18-V21 PolarHBondContact O-N 2.99Å; L18-L22 WeakPolarHBondContact O-CB 3.24Å; L18-L22 PolarHBondContact O-N 3.22Å
19	L	60.1	Low	58.8	Low	133 Å²	133	125.9 Å²	125.9	70%	0.696	63%	0.633	S	S	*	*	H	α-helix	trans	-61.7	-40.2	175.2	-99.1	89.2	0	0	0	113.3	S17 L22 T23	S17-L19 PolarHBondContact O-N 2.76Å; L19-L22 PolarHBondContact O-N 3.5Å; L19-T23 PolarHBondContact O-N 3.48Å; L19-T23 PolarHBondContact O-OG1 2.86Å; L19-T23 VanDerWaalsContact O-OG1 3.06Å
20	S	65.4	Low	60.5	Low	49 Å²	49	121.2 Å²	121.2	34%	0.343	62%	0.619	S	S	.	*	H	α-helix	trans	-70.3	-31.9	-178.4	66	0	0	0	0	113	S17 T23 V24	S17-S20 PolarHBondContact N-OG 3.43Å; S17-S20 PolarHBondContact O-N 3.21Å; S17-S20 PolarHBondContact O-OG 3.48Å; S17-S20 PolarHBondContact OG-N 2.69Å; S20-T23 WeakPolarHBondContact CA-OG1 3.48Å; S20-T23 PolarHBondContact O-OG1 2.77Å; S20-V24 WeakPolarHBondContact O-CG2 3.38Å; S20-V24 PolarHBondContact O-N 2.63Å
21	V	72.4	Confident	62.1	Low	71 Å²	71	116.5 Å²	116.5	43%	0.43	60%	0.599	S	S	.	*	H	α-helix	trans	-75.4	-38.8	174.4	-179.6	0	0	0	0	109.9	P16 S17 L18 V24 I25	P16-V21 HydrophobicContact CB-CG2 4.23Å; P16-V21 HydrophobicContact CG-CG2 4.35Å; S17-V21 PolarHBondContact O-N 3.37Å; L18-V21 PolarHBondContact O-N 2.99Å; V21-V24 PolarHBondContact O-N 2.83Å; V21-I25 HydrophobicContact CG1-CD1 3.88Å; V21-I25 VanDerWaalsContact O-CG1 3.29Å; V21-I25 WeakPolarHBondContact O-CG1 3.22Å; V21-I25 PolarHBondContact O-N 2.91Å
22	L	73.1	Confident	62.9	Low	106 Å²	106	108 Å²	108	56%	0.555	58%	0.578	S	S	*	*	H	α-helix	trans	-64.4	-40.8	178.1	-159.5	78.9	0	0	0	112.3	L18 L19 I25 I26	L18-L22 WeakPolarHBondContact O-CB 3.24Å; L18-L22 PolarHBondContact O-N 3.22Å; L19-L22 PolarHBondContact O-N 3.5Å; L22-I25 PolarHBondContact O-N 3.28Å; L22-I26 HydrophobicContact CG-CD1 4.32Å; L22-I26 VanDerWaalsContact O-CG1 3.27Å; L22-I26 WeakPolarHBondContact O-CG1 3.48Å; L22-I26 PolarHBondContact O-N 3.4Å
23	T	72.8	Confident	63.9	Low	76 Å²	76	106.2 Å²	106.2	47%	0.466	57%	0.57	S	S	.	*	H	α-helix	trans	-66	-38.6	177.3	42.7	0	0	0	0	112.7	L19 S20 I26 L27	L19-T23 PolarHBondContact O-N 3.48Å; L19-T23 PolarHBondContact O-OG1 2.86Å; L19-T23 VanDerWaalsContact O-OG1 3.06Å; S20-T23 WeakPolarHBondContact CA-OG1 3.48Å; S20-T23 PolarHBondContact O-OG1 2.77Å; T23-I26 PolarHBondContact O-N 2.72Å; T23-L27 WeakPolarHBondContact O-CG 3.21Å; T23-L27 PolarHBondContact O-N 2.84Å
24	V	74.8	Confident	64.5	Low	82 Å²	82	106.3 Å²	106.3	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-66.6	-40.5	175.4	174.3	0	0	0	0	111	S20 V21 L27 L28	S20-V24 WeakPolarHBondContact O-CG2 3.38Å; S20-V24 PolarHBondContact O-N 2.63Å; V21-V24 PolarHBondContact O-N 2.83Å; V24-L27 PolarHBondContact O-N 2.95Å; V24-L28 HydrophobicContact CG1-CD1 3.92Å; V24-L28 HydrophobicContact CG1-CG 4.45Å; V24-L28 WeakPolarHBondContact O-CB 3.43Å; V24-L28 VanDerWaalsContact O-CG 3.3Å; V24-L28 WeakPolarHBondContact O-CG 3.31Å; V24-L28 PolarHBondContact O-N 3.35Å
25	I	75.8	Confident	64.7	Low	85 Å²	85	102.6 Å²	102.6	44%	0.436	56%	0.555	S	S	.	*	H	α-helix	trans	-64	-42.2	175.8	-68.8	168.3	0	0	0	111.1	V21 L22 L28 L29	V21-I25 HydrophobicContact CG1-CD1 3.88Å; V21-I25 VanDerWaalsContact O-CG1 3.29Å; V21-I25 WeakPolarHBondContact O-CG1 3.22Å; V21-I25 PolarHBondContact O-N 2.91Å; L22-I25 PolarHBondContact O-N 3.28Å; I25-L28 PolarHBondContact O-N 2.83Å; I25-L29 HydrophobicContact CG2-CD1 3.9Å; I25-L29 HydrophobicContact CG2-CG 4.36Å; I25-L29 WeakPolarHBondContact O-CB 3.35Å; I25-L29 VanDerWaalsContact O-CG 3.27Å; I25-L29 WeakPolarHBondContact O-CG 3.34Å; I25-L29 PolarHBondContact O-N 2.94Å
26	I	75.6	Confident	64	Low	91 Å²	91	105.9 Å²	105.9	47%	0.467	56%	0.56	S	S	.	*	H	α-helix	trans	-63.8	-42.9	176.9	-67.8	169.1	0	0	0	111	L22 T23 L28 L29 V30	L22-I26 HydrophobicContact CG-CD1 4.32Å; L22-I26 VanDerWaalsContact O-CG1 3.27Å; L22-I26 WeakPolarHBondContact O-CG1 3.48Å; L22-I26 PolarHBondContact O-N 3.4Å; T23-I26 PolarHBondContact O-N 2.72Å; I26-L28 VanDerWaalsContact C-N 3.34Å; I26-L28 PolarHBondContact O-N 2.9Å; I26-L29 PolarHBondContact O-N 3.36Å; I26-V30 HydrophobicContact CG2-CG2 4.33Å; I26-V30 WeakPolarHBondContact O-CB 3.39Å; I26-V30 VanDerWaalsContact O-CG2 3.26Å; I26-V30 WeakPolarHBondContact O-CG2 3.1Å; I26-V30 PolarHBondContact O-N 3.02Å
27	L	71.8	Confident	63.6	Low	121 Å²	121	107.3 Å²	107.3	63%	0.634	56%	0.562	S	S	*	*	H	α-helix	trans	-63.7	-38.7	176.4	-80.6	160.9	0	0	0	112.3	T23 V24 V30 S31	T23-L27 WeakPolarHBondContact O-CG 3.21Å; T23-L27 PolarHBondContact O-N 2.84Å; V24-L27 PolarHBondContact O-N 2.95Å; L27-V30 PolarHBondContact O-N 3.03Å; L27-S31 WeakPolarHBondContact O-CB 3.3Å; L27-S31 PolarHBondContact O-N 3.35Å; L27-S31 PolarHBondContact O-OG 3.06Å
28	L	71.2	Confident	62.3	Low	107 Å²	107	108.3 Å²	108.3	56%	0.56	57%	0.567	S	S	*	*	H	α-helix	trans	-67.9	-37.2	175	-73	169.5	0	0	0	112.3	V24 I25 I26 S31 A32	V24-L28 HydrophobicContact CG1-CD1 3.92Å; V24-L28 HydrophobicContact CG1-CG 4.45Å; V24-L28 WeakPolarHBondContact O-CB 3.43Å; V24-L28 VanDerWaalsContact O-CG 3.3Å; V24-L28 WeakPolarHBondContact O-CG 3.31Å; V24-L28 PolarHBondContact O-N 3.35Å; I25-L28 PolarHBondContact O-N 2.83Å; I26-L28 VanDerWaalsContact C-N 3.34Å; I26-L28 PolarHBondContact O-N 2.9Å; L28-S31 VanDerWaalsContact CA-OG 3.27Å; L28-S31 WeakPolarHBondContact CA-OG 3.45Å; L28-S31 PolarHBondContact O-OG 2.9Å; L28-A32 VanDerWaalsContact O-CB 3.24Å; L28-A32 WeakPolarHBondContact O-CB 3.47Å; L28-A32 PolarHBondContact O-N 3.41Å
29	L	69.4	Low	61.3	Low	114 Å²	114	109.8 Å²	109.8	60%	0.597	57%	0.57	S	S	*	*	H	α-helix	trans	-70.3	-38.5	175.1	-71.4	171.2	0	0	0	112.2	I25 I26 K33	I25-L29 HydrophobicContact CG2-CD1 3.9Å; I25-L29 HydrophobicContact CG2-CG 4.36Å; I25-L29 WeakPolarHBondContact O-CB 3.35Å; I25-L29 VanDerWaalsContact O-CG 3.27Å; I25-L29 WeakPolarHBondContact O-CG 3.34Å; I25-L29 PolarHBondContact O-N 2.94Å; I26-L29 PolarHBondContact O-N 3.36Å; L29-K33 WeakPolarHBondContact O-CB 3.49Å; L29-K33 PolarHBondContact O-N 3.37Å
30	V	66.3	Low	60.2	Low	78 Å²	78	112.8 Å²	112.8	47%	0.473	58%	0.578	S	S	.	*	H	α-helix	trans	-67.6	-41.8	175.9	171.4	0	0	0	0	111	I26 L27 K33 Y34	I26-V30 HydrophobicContact CG2-CG2 4.33Å; I26-V30 WeakPolarHBondContact O-CB 3.39Å; I26-V30 VanDerWaalsContact O-CG2 3.26Å; I26-V30 WeakPolarHBondContact O-CG2 3.1Å; I26-V30 PolarHBondContact O-N 3.02Å; L27-V30 PolarHBondContact O-N 3.03Å; V30-K33 PolarHBondContact O-N 3.04Å; V30-Y34 PolarHBondContact O-N 3.47Å
31	S	62.6	Low	58.7	Low	50 Å²	50	118.3 Å²	118.3	35%	0.35	60%	0.602	S	S	.	*	H	α-helix	trans	-68.4	-40.3	175.7	47.8	0	0	0	0	112.2	L27 L28 K33 Y34 I35	L27-S31 WeakPolarHBondContact O-CB 3.3Å; L27-S31 PolarHBondContact O-N 3.35Å; L27-S31 PolarHBondContact O-OG 3.06Å; L28-S31 VanDerWaalsContact CA-OG 3.27Å; L28-S31 WeakPolarHBondContact CA-OG 3.45Å; L28-S31 PolarHBondContact O-OG 2.9Å; S31-K33 VanDerWaalsContact C-N 3.3Å; S31-K33 PolarHBondContact O-N 3.39Å; S31-Y34 PolarHBondContact O-N 3.46Å; S31-Y34 VanDerWaalsContact O-N 3.13Å; S31-I35 WeakPolarHBondContact O-CD1 3.49Å; S31-I35 VanDerWaalsContact O-CG1 3.25Å; S31-I35 WeakPolarHBondContact O-CG1 3.29Å; S31-I35 PolarHBondContact O-N 3.03Å
32	A	60.6	Low	56.8	Low	52 Å²	52	122.1 Å²	122.1	43%	0.43	62%	0.621	S	S	.	*	H	α-helix	trans	-61.3	-37.2	171.9	0	0	0	0	0	112.4	L28 Y34 I35 Y36	L28-A32 VanDerWaalsContact O-CB 3.24Å; L28-A32 WeakPolarHBondContact O-CB 3.47Å; L28-A32 PolarHBondContact O-N 3.41Å; A32-Y34 VanDerWaalsContact C-N 3.34Å; A32-I35 PolarHBondContact O-N 3Å; A32-Y36 PolarHBondContact O-N 2.74Å
33	K	55.2	Low	55.1	Low	172 Å²	172	122.1 Å²	122.1	75%	0.748	63%	0.627	S	S	*	*	H	α-helix	trans	-67.8	-31.9	173.9	-129.4	-177.4	177.2	-176.7	0	113.1	L29 V30 S31	L29-K33 WeakPolarHBondContact O-CB 3.49Å; L29-K33 PolarHBondContact O-N 3.37Å; V30-K33 PolarHBondContact O-N 3.04Å; S31-K33 VanDerWaalsContact C-N 3.3Å; S31-K33 PolarHBondContact O-N 3.39Å
34	Y	52.2	Low	53.3	Low	180 Å²	180	124.4 Å²	124.4	71%	0.706	64%	0.643	S	S	*	*	H	α-helix	trans	-77.6	-30.4	177	-114.1	-89.1	0	0	0	112.9	V30 S31 A32 Y36	V30-Y34 PolarHBondContact O-N 3.47Å; S31-Y34 PolarHBondContact O-N 3.46Å; S31-Y34 VanDerWaalsContact O-N 3.13Å; A32-Y34 VanDerWaalsContact C-N 3.34Å; Y34-Y36 VanDerWaalsContact C-N 3.32Å
35	I	50.9	Low	51.7	Low	139 Å²	139	126 Å²	126	71%	0.713	66%	0.658	S	S	*	*	H	α-helix	trans	-75.2	-24.2	176.4	-66.1	163.3	0	0	0	111.3	S31 A32	S31-I35 WeakPolarHBondContact O-CD1 3.49Å; S31-I35 VanDerWaalsContact O-CG1 3.25Å; S31-I35 WeakPolarHBondContact O-CG1 3.29Å; S31-I35 PolarHBondContact O-N 3.03Å; A32-I35 PolarHBondContact O-N 3Å
36	Y	39.6	Very low	49.8	Very low	205 Å²	205	125.3 Å²	125.3	80%	0.804	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	39	-178.7	-115.5	-85.5	0	0	0	113.6	A32 Y34 P38	A32-Y36 PolarHBondContact O-N 2.74Å; Y34-Y36 VanDerWaalsContact C-N 3.32Å; Y36-P38 WeakPolarHBondContact O-CD 3.38Å
37	I	41.8	Very low	48	Very low	111 Å²	111	125.9 Å²	125.9	57%	0.569	67%	0.674	S	S	*	*			trans	-88	110.7	160.6	-57.8	177.7	0	0	0	105.9	E39	I37-E39 PolarHBondContact O-N 3.08Å
38	P	38.4	Very low	46.7	Very low	94 Å²	94	126.6 Å²	126.6	61%	0.61	68%	0.677	S	S	*	*			trans	-60.8	126.3	171.3	-12.2	27	0	0	0	107.4	Y36 F40	Y36-P38 WeakPolarHBondContact O-CD 3.38Å; P38-F40 PolarHBondContact O-N 2.74Å
39	E	37.6	Very low	45.2	Very low	190 Å²	190	125.6 Å²	125.6	89%	0.888	68%	0.68	S	S	*	*			trans	-49.8	110.1	162.3	-107	170.6	165.9	0	0	107.5	I37 L41	I37-E39 PolarHBondContact O-N 3.08Å; E39-L41 PolarHBondContact O-N 3.21Å
40	F	36.5	Very low	44.2	Very low	196 Å²	196	127.7 Å²	127.7	86%	0.86	69%	0.686	S	S	*	*			trans	-65.5	106.6	169.2	-94.6	-92.8	0	0	0	106.2	P38 D42	P38-F40 PolarHBondContact O-N 2.74Å; F40-D42 PolarHBondContact O-N 2.98Å; F40-D42 VanDerWaalsContact O-N 3.1Å
41	L	33.6	Very low	43.4	Very low	164 Å²	164	125 Å²	125	86%	0.859	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-53.4	116.2	163.7	-81.8	156.7	0	0	0	107.5	E39	E39-L41 PolarHBondContact O-N 3.21Å
42	D	34.4	Very low	43.3	Very low	152 Å²	152	125.3 Å²	125.3	81%	0.813	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-52.2	128.9	170.6	-79.5	-45.5	0	0	0	108.3	F40	F40-D42 PolarHBondContact O-N 2.98Å; F40-D42 VanDerWaalsContact O-N 3.1Å
43	P	36.4	Very low	43.8	Very low	106 Å²	106	127.6 Å²	127.6	69%	0.688	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-59.5	146.8	174.6	24.1	-30.6	0	0	0	109.1	S45	P43-S45 PolarHBondContact O-N 3.42Å
44	P	35.4	Very low	45.1	Very low	123 Å²	123	126.6 Å²	126.6	80%	0.799	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-53.4	132.8	180	22.1	-31.5	0	0	0	109.3	A46	P44-A46 PolarHBondContact O-N 3.48Å
45	S	40.7	Very low	46.8	Very low	117 Å²	117	119.9 Å²	119.9	82%	0.818	65%	0.645	S	S	*	*			trans	-44	112.8	-179.8	52.2	0	0	0	0	110.1	P43	P43-S45 PolarHBondContact O-N 3.42Å
46	A	35.6	Very low	48.7	Very low	70 Å²	70	121 Å²	121	58%	0.579	65%	0.653	S	S	*	*			trans	-53.4	143.2	172.3	0	0	0	0	0	108.9	P44 I48	P44-A46 PolarHBondContact O-N 3.48Å; A46-I48 PolarHBondContact O-N 2.92Å
47	P	37.6	Very low	51.3	Low	103 Å²	103	112 Å²	112	67%	0.669	62%	0.618	S	S	*	*			trans	-54.1	142.4	176.5	1.4	-0.5	0	0	0	109.7	S49 Q50	P47-S49 PolarHBondContact O-N 2.79Å; P47-Q50 PolarHBondContact O-N 3.37Å
48	I	45.8	Very low	53.9	Low	135 Å²	135	109.3 Å²	109.3	69%	0.692	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.5	-10.1	180	-63.2	163	0	0	0	113.3	A46 F92	A46-I48 PolarHBondContact O-N 2.92Å; I48-F92 HydrophobicContact CG2-CD2 4.43Å
49	S	39.7	Very low	56.7	Low	87 Å²	87	104.9 Å²	104.9	61%	0.608	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-9.6	-179	-173.6	0	0	0	0	116.7	P47	P47-S49 PolarHBondContact O-N 2.79Å
50	Q	46.7	Very low	59.6	Low	158 Å²	158	101.5 Å²	101.5	74%	0.738	56%	0.563	S	S	*	*			trans	-122.6	63	178.9	-82.6	-179.6	-13.1	0	0	111.7	P47 F52	P47-Q50 PolarHBondContact O-N 3.37Å; Q50-F52 PolarHBondContact O-N 2.58Å
51	S	50.9	Low	62.5	Low	20 Å²	20	93 Å²	93	14%	0.14	53%	0.529	C	S	.	.			trans	-81	1.7	176.8	82.5	0	0	0	0	113.9	W130	S51-W130 VanDerWaalsContact OG-CH2 3.3Å; S51-W130 WeakPolarHBondContact OG-CH2 3.44Å
52	F	60.4	Low	65.6	Low	57 Å²	57	85.3 Å²	85.3	25%	0.25	49%	0.488	C	S	.	.	S	Bend	trans	-131.8	120.1	174.8	-103.1	-91.6	0	0	0	109.8	Q50 K54 R103 W130 R134	Q50-F52 PolarHBondContact O-N 2.58Å; F52-K54 VanDerWaalsContact C-N 3.3Å; F52-K54 PolarHBondContact O-N 3.27Å; F52-R103 VanDerWaalsContact CE2-NH2 3.34Å; F52-W130 HydrophobicContact CD2-CZ3 4.33Å; F52-W130 AromaticContact CE2-CE3 3.68Å; F52-W130 HydrophobicContact CE2-CE3 3.68Å; F52-W130 AromaticContact CE2-CZ3 3.82Å; F52-W130 HydrophobicContact CE2-CZ3 3.82Å; F52-W130 HydrophobicContact CZ-CE3 4.43Å; F52-R134 HydrophobicContact CE1-CG 4.07Å; F52-R134 VanDerWaalsContact CE1-CZ 3.47Å; F52-R134 HydrophobicContact CE2-CG 4.22Å; F52-R134 HydrophobicContact CZ-CG 3.39Å
53	V	70.1	Confident	68.6	Low	100 Å²	100	80.8 Å²	80.8	61%	0.606	46%	0.46	S	S	*	.			trans	-69.5	94	168.7	-178	0	0	0	0	107.2	H55	V53-H55 PolarHBondContact O-CD2 2.76Å; V53-H55 PolarHBondContact O-N 2.79Å
54	K	81.9	Confident	71.5	Confident	152 Å²	152	79.6 Å²	79.6	66%	0.661	45%	0.448	S	S	*	.			trans	-70.8	111.4	167.2	-171	170.5	-174.8	162.2	0	107.6	F52 E412	F52-K54 VanDerWaalsContact C-N 3.3Å; F52-K54 PolarHBondContact O-N 3.27Å; K54-E412 WeakPolarHBondContact CE-OE1 3.01Å; K54-E412 IonicContact NZ-OE1 3.44Å; K54-E412 PolarHBondContact NZ-OE1 2.59Å
55	H	88.3	Confident	74.4	Confident	38 Å²	38	78.9 Å²	78.9	18%	0.176	44%	0.436	C	S	.	.			trans	-75.1	139.7	178	-62.7	-77.7	0	0	0	109.5	V53 I57 I76 I405 Q408	V53-H55 PolarHBondContact O-CD2 2.76Å; V53-H55 PolarHBondContact O-N 2.79Å; H55-I57 PolarHBondContact O-N 3.36Å; H55-I76 HydrophobicContact CB-CD1 4.3Å; H55-I405 HydrophobicContact CB-CD1 3.31Å; H55-I405 VanDerWaalsContact CD2-CD1 3.46Å; H55-I405 WeakPolarHBondContact CD2-CD1 3.37Å; H55-Q408 PolarHBondContact O-NE2 3.4Å; H55-Q408 VanDerWaalsContact O-NE2 3.12Å
56	N	91.3	Very high	77.1	Confident	164 Å²	164	76.3 Å²	76.3	88%	0.877	41%	0.413	S	S	*	.	S	Bend	trans	-73.8	74.6	174.3	-171.9	21.6	0	0	0	109.9
57	I	94.4	Very high	80	Confident	14 Å²	14	77.9 Å²	77.9	7%	0.072	42%	0.417	C	S	.	.			trans	-129.8	141	177.4	-76.9	-70.1	0	0	0	108.7	H55 C59 I62 E69 K72 I76 I405	H55-I57 PolarHBondContact O-N 3.36Å; I57-C59 PolarHBondContact O-N 3.38Å; I57-I62 HydrophobicContact CG2-CD1 4.14Å; I57-I62 HydrophobicContact CG2-CG1 3.58Å; I57-E69 WeakPolarHBondContact CA-OE1 3.45Å; I57-E69 HydrophobicContact CD1-CG 4.22Å; I57-E69 WeakPolarHBondContact CD1-OE1 3.43Å; I57-E69 HydrophobicContact CG2-CG 4.18Å; I57-K72 HydrophobicContact CD1-CB 3.52Å; I57-K72 HydrophobicContact CD1-CD 4.28Å; I57-I76 HydrophobicContact CD1-CD1 3.81Å; I57-I76 HydrophobicContact CG1-CD1 3.53Å; I57-I405 HydrophobicContact CB-CG2 4.38Å; I57-I405 HydrophobicContact CG1-CD1 3.95Å; I57-I405 HydrophobicContact CG1-CG1 4.49Å; I57-I405 HydrophobicContact CG1-CG2 4.3Å; I57-I405 HydrophobicContact CG2-CG2 3.81Å
58	S	97.2	Very high	82.9	Confident	55 Å²	55	77.5 Å²	77.5	39%	0.385	41%	0.412	S	S	.	.			trans	-83.3	99.5	167.9	176.1	0	0	0	0	110.4	K60 A61 I62 E69	S58-K60 PolarHBondContact O-N 2.99Å; S58-A61 PolarHBondContact O-N 3.28Å; S58-A61 WeakPolarHBondContact OG-CB 3.36Å; S58-A61 PolarHBondContact OG-N 3.35Å; S58-I62 PolarHBondContact O-N 3.07Å; S58-E69 PolarHBondContact N-OE1 3.06Å
59	C	97.3	Very high	85.3	Confident	2 Å²	2	71.8 Å²	71.8	1%	0.014	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-24.4	176.7	-71.1	0	0	0	0	113.6	I57 Y63 C409 E412	I57-C59 PolarHBondContact O-N 3.38Å; C59-Y63 WeakPolarHBondContact O-CB 3.26Å; C59-Y63 PolarHBondContact O-N 3.12Å; C59-C409 WeakPolarHBondContact CA-SG 3.39Å; C59-C409 HydrophobicContact CB-CB 3.48Å; C59-C409 VanDerWaalsContact CB-CB 3.48Å; C59-C409 WeakPolarHBondContact CB-SG 3.47Å; C59-C409 WeakPolarHBondContact SG-CA 3.21Å; C59-C409 WeakPolarHBondContact SG-CB 3.49Å; C59-C409 CovalentContact SG-SG 2.05Å; C59-C409 PolarHBondContact SG-SG 3.26Å; C59-E412 HydrophobicContact CB-CB 4.45Å; C59-E412 WeakPolarHBondContact CB-OE2 3.33Å; C59-E412 PolarHBondContact SG-OE2 3.41Å
60	K	97.4	Very high	88	Confident	119 Å²	119	68.9 Å²	68.9	52%	0.517	36%	0.361	S	S	.	.	H	α-helix	trans	-64	-47.9	166.9	174	166.7	167	46.6	0	111.4	S58 I62 Y63 D64	S58-K60 PolarHBondContact O-N 2.99Å; K60-I62 VanDerWaalsContact C-N 3.35Å; K60-I62 PolarHBondContact O-N 3.34Å; K60-Y63 WeakPolarHBondContact O-CB 3.3Å; K60-Y63 PolarHBondContact O-N 2.9Å; K60-Y63 VanDerWaalsContact O-N 3.16Å; K60-D64 WeakPolarHBondContact CG-OD2 3.44Å; K60-D64 IonicContact NZ-OD1 2.72Å; K60-D64 PolarHBondContact NZ-OD1 3.13Å; K60-D64 IonicContact NZ-OD2 2.66Å; K60-D64 PolarHBondContact NZ-OD2 2.99Å; K60-D64 PolarHBondContact O-N 3.19Å
61	A	98	Very high	90.3	Very high	18 Å²	18	62.6 Å²	62.6	15%	0.149	34%	0.339	C	S	.	.	H	α-helix	trans	-67.7	-34.4	179.8	0	0	0	0	0	112.3	S58 D64 M65 D66 E69	S58-A61 PolarHBondContact O-N 3.28Å; S58-A61 WeakPolarHBondContact OG-CB 3.36Å; S58-A61 PolarHBondContact OG-N 3.35Å; A61-D64 CarbonylContact O-C 3.54Å; A61-D64 PolarHBondContact O-N 2.92Å; A61-M65 PolarHBondContact O-N 3.02Å; A61-M65 VanDerWaalsContact O-N 3.11Å; A61-D66 HydrophobicContact CB-CB 3.89Å; A61-D66 WeakPolarHBondContact O-CB 3.49Å; A61-D66 PolarHBondContact O-N 3.13Å; A61-E69 HydrophobicContact CB-CB 3.82Å; A61-E69 HydrophobicContact CB-CG 3.91Å
62	I	98	Very high	92.4	Very high	1 Å²	1	66 Å²	66	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-59.5	-46.3	168.9	-62.7	-65.8	0	0	0	111	I57 S58 K60 D64 M65 E69 V70 A381 L384 I405	I57-I62 HydrophobicContact CG2-CD1 4.14Å; I57-I62 HydrophobicContact CG2-CG1 3.58Å; S58-I62 PolarHBondContact O-N 3.07Å; K60-I62 VanDerWaalsContact C-N 3.35Å; K60-I62 PolarHBondContact O-N 3.34Å; I62-D64 VanDerWaalsContact C-N 3.32Å; I62-D64 PolarHBondContact O-N 3.03Å; I62-M65 WeakPolarHBondContact O-CA 3.4Å; I62-M65 PolarHBondContact O-N 3.4Å; I62-E69 VanDerWaalsContact CD1-C 3.48Å; I62-E69 HydrophobicContact CD1-CB 4.05Å; I62-E69 HydrophobicContact CD1-CG 3.82Å; I62-E69 WeakPolarHBondContact CD1-O 3.19Å; I62-E69 HydrophobicContact CG1-CG 4.01Å; I62-V70 HydrophobicContact CD1-CG2 4.2Å; I62-A381 HydrophobicContact CG2-CB 4.22Å; I62-A381 VanDerWaalsContact CG2-O 3.24Å; I62-A381 WeakPolarHBondContact CG2-O 3.03Å; I62-L384 HydrophobicContact CB-CD2 4.21Å; I62-L384 HydrophobicContact CG2-CB 4.06Å; I62-L384 HydrophobicContact CG2-CD2 3.72Å; I62-I405 HydrophobicContact CG1-CG2 4.49Å
63	Y	97.8	Very high	93.9	Very high	58 Å²	58	63.3 Å²	63.3	23%	0.227	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-36.8	177.7	177.2	-91.3	0	0	0	112.8	C59 K60 M65 L384 H385 L388 N389	C59-Y63 WeakPolarHBondContact O-CB 3.26Å; C59-Y63 PolarHBondContact O-N 3.12Å; K60-Y63 WeakPolarHBondContact O-CB 3.3Å; K60-Y63 PolarHBondContact O-N 2.9Å; K60-Y63 VanDerWaalsContact O-N 3.16Å; Y63-M65 PolarHBondContact O-N 3.46Å; Y63-L384 HydrophobicContact CD2-CG 4.37Å; Y63-H385 AromaticContact CE1-ND1 3.88Å; Y63-H385 AromaticContact CE2-ND1 3.98Å; Y63-H385 AromaticContact CZ-ND1 3.74Å; Y63-H385 WeakPolarHBondContact O-CB 3.39Å; Y63-H385 PolarHBondContact O-ND1 2.95Å; Y63-L388 HydrophobicContact CD2-CD1 3.9Å; Y63-L388 HydrophobicContact CE2-CB 4.17Å; Y63-L388 HydrophobicContact CE2-CD1 3.94Å; Y63-N389 PolarHBondContact OH-ND2 2.95Å
64	D	97.6	Very high	95	Very high	81 Å²	81	61.4 Å²	61.4	43%	0.433	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	2.4	175.6	-60.1	-29.9	0	0	0	112.3	K60 A61 I62 D66	K60-D64 WeakPolarHBondContact CG-OD2 3.44Å; K60-D64 IonicContact NZ-OD1 2.72Å; K60-D64 PolarHBondContact NZ-OD1 3.13Å; K60-D64 IonicContact NZ-OD2 2.66Å; K60-D64 PolarHBondContact NZ-OD2 2.99Å; K60-D64 PolarHBondContact O-N 3.19Å; A61-D64 CarbonylContact O-C 3.54Å; A61-D64 PolarHBondContact O-N 2.92Å; I62-D64 VanDerWaalsContact C-N 3.32Å; I62-D64 PolarHBondContact O-N 3.03Å; D64-D66 VanDerWaalsContact C-N 3.28Å; D64-D66 PolarHBondContact O-N 3.34Å
65	M	96	Very high	95.4	Very high	108 Å²	108	58.9 Å²	58.9	53%	0.532	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	35.2	-178.8	-56.5	-179.2	-69.8	0	0	113.6	A61 I62 Y63 H385	A61-M65 PolarHBondContact O-N 3.02Å; A61-M65 VanDerWaalsContact O-N 3.11Å; I62-M65 WeakPolarHBondContact O-CA 3.4Å; I62-M65 PolarHBondContact O-N 3.4Å; Y63-M65 PolarHBondContact O-N 3.46Å; M65-H385 HydrophobicContact CG-CB 3.97Å; M65-H385 HydrophobicContact SD-CB 4.07Å
66	D	98	Very high	95.4	Very high	63 Å²	63	58.7 Å²	58.7	34%	0.337	32%	0.318	S	S	.	.			trans	-59.9	121.3	173.8	177.4	-94.1	0	0	0	110.3	A61 D64 V68 E69 V70	A61-D66 HydrophobicContact CB-CB 3.89Å; A61-D66 WeakPolarHBondContact O-CB 3.49Å; A61-D66 PolarHBondContact O-N 3.13Å; D64-D66 VanDerWaalsContact C-N 3.28Å; D64-D66 PolarHBondContact O-N 3.34Å; D66-V68 VanDerWaalsContact C-N 3.26Å; D66-V68 PolarHBondContact O-N 3.23Å; D66-V68 WeakPolarHBondContact OD1-CA 3.43Å; D66-V68 WeakPolarHBondContact OD1-CB 3.45Å; D66-V68 PolarHBondContact OD1-N 2.71Å; D66-E69 HydrophobicContact CB-CB 4.2Å; D66-E69 PolarHBondContact O-N 3.46Å; D66-E69 PolarHBondContact OD1-N 3.09Å; D66-V70 WeakPolarHBondContact O-CB 3.47Å; D66-V70 WeakPolarHBondContact O-CG2 3.46Å; D66-V70 PolarHBondContact O-N 2.88Å
67	P	96.6	Very high	95.1	Very high	103 Å²	103	54.2 Å²	54.2	67%	0.669	29%	0.289	S	S	*	.	H	α-helix	trans	-66.1	-28.9	-171.6	24.9	-34.2	0	0	0	112.8	G71	P67-G71 PolarHBondContact O-N 3.09Å
68	V	97	Very high	94.6	Very high	94 Å²	94	63.5 Å²	63.5	57%	0.57	32%	0.323	S	S	*	.	H	α-helix	trans	-71.2	-46.2	178.5	178.1	0	0	0	0	109.6	D66 G71 K72	D66-V68 VanDerWaalsContact C-N 3.26Å; D66-V68 PolarHBondContact O-N 3.23Å; D66-V68 WeakPolarHBondContact OD1-CA 3.43Å; D66-V68 WeakPolarHBondContact OD1-CB 3.45Å; D66-V68 PolarHBondContact OD1-N 2.71Å; V68-G71 PolarHBondContact O-N 2.87Å; V68-K72 WeakPolarHBondContact O-CG 3.39Å; V68-K72 PolarHBondContact O-N 3.35Å
69	E	97.3	Very high	93.7	Very high	16 Å²	16	67.7 Å²	67.7	8%	0.075	34%	0.335	C	S	.	.	H	α-helix	trans	-68.8	-41.6	-179.9	-152.6	68.9	-168.5	0	0	112	I57 S58 A61 I62 D66 G71 K72 S73	I57-E69 WeakPolarHBondContact CA-OE1 3.45Å; I57-E69 HydrophobicContact CD1-CG 4.22Å; I57-E69 WeakPolarHBondContact CD1-OE1 3.43Å; I57-E69 HydrophobicContact CG2-CG 4.18Å; S58-E69 PolarHBondContact N-OE1 3.06Å; A61-E69 HydrophobicContact CB-CB 3.82Å; A61-E69 HydrophobicContact CB-CG 3.91Å; I62-E69 VanDerWaalsContact CD1-C 3.48Å; I62-E69 HydrophobicContact CD1-CB 4.05Å; I62-E69 HydrophobicContact CD1-CG 3.82Å; I62-E69 WeakPolarHBondContact CD1-O 3.19Å; I62-E69 HydrophobicContact CG1-CG 4.01Å; D66-E69 HydrophobicContact CB-CB 4.2Å; D66-E69 PolarHBondContact O-N 3.46Å; D66-E69 PolarHBondContact OD1-N 3.09Å; E69-G71 VanDerWaalsContact C-N 3.3Å; E69-G71 PolarHBondContact O-N 2.84Å; E69-K72 WeakPolarHBondContact O-CB 3.38Å; E69-K72 PolarHBondContact O-N 2.94Å; E69-K72 VanDerWaalsContact O-N 3.16Å; E69-K72 IonicContact OE1-NZ 2.71Å; E69-K72 WeakPolarHBondContact OE2-CD 3.38Å; E69-K72 WeakPolarHBondContact OE2-CE 3.22Å; E69-K72 IonicContact OE2-NZ 3.29Å; E69-K72 PolarHBondContact OE2-NZ 3.4Å; E69-S73 PolarHBondContact O-N 3.12Å
70	V	95.9	Very high	92	Very high	25 Å²	25	74 Å²	74	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-58.7	-44.6	171.3	173.5	0	0	0	0	109.8	I62 D66 K72 S73 L74 A382	I62-V70 HydrophobicContact CD1-CG2 4.2Å; D66-V70 WeakPolarHBondContact O-CB 3.47Å; D66-V70 WeakPolarHBondContact O-CG2 3.46Å; D66-V70 PolarHBondContact O-N 2.88Å; V70-K72 VanDerWaalsContact C-N 3.35Å; V70-K72 PolarHBondContact O-N 3.09Å; V70-S73 WeakPolarHBondContact O-CB 3.48Å; V70-S73 PolarHBondContact O-N 2.9Å; V70-S73 VanDerWaalsContact O-N 3.14Å; V70-S73 PolarHBondContact O-OG 2.72Å; V70-L74 WeakPolarHBondContact O-CG 3.24Å; V70-L74 PolarHBondContact O-N 2.94Å; V70-L74 VanDerWaalsContact O-N 3.16Å; V70-A382 HydrophobicContact CG1-CB 3.99Å
71	G	95.1	Very high	90.5	Very high	27 Å²	27	70.1 Å²	70.1	28%	0.278	36%	0.36	S	S	.	.	H	α-helix	trans	-57.5	-41.6	174	0	0	0	0	0	113.7	P67 V68 E69 S73 L74 I75	P67-G71 PolarHBondContact O-N 3.09Å; V68-G71 PolarHBondContact O-N 2.87Å; E69-G71 VanDerWaalsContact C-N 3.3Å; E69-G71 PolarHBondContact O-N 2.84Å; G71-S73 PolarHBondContact O-N 3.04Å; G71-L74 WeakPolarHBondContact O-CB 3.29Å; G71-L74 PolarHBondContact O-N 3.49Å; G71-I75 WeakPolarHBondContact O-CG1 3.24Å; G71-I75 PolarHBondContact O-N 2.89Å
72	K	94.5	Very high	88.9	Confident	91 Å²	91	74.4 Å²	74.4	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-41.8	174.4	-69.4	174.7	-168.5	161.2	0	111.9	I57 V68 E69 V70 L74 I75 I76	I57-K72 HydrophobicContact CD1-CB 3.52Å; I57-K72 HydrophobicContact CD1-CD 4.28Å; V68-K72 WeakPolarHBondContact O-CG 3.39Å; V68-K72 PolarHBondContact O-N 3.35Å; E69-K72 WeakPolarHBondContact O-CB 3.38Å; E69-K72 PolarHBondContact O-N 2.94Å; E69-K72 VanDerWaalsContact O-N 3.16Å; E69-K72 IonicContact OE1-NZ 2.71Å; E69-K72 WeakPolarHBondContact OE2-CD 3.38Å; E69-K72 WeakPolarHBondContact OE2-CE 3.22Å; E69-K72 IonicContact OE2-NZ 3.29Å; E69-K72 PolarHBondContact OE2-NZ 3.4Å; V70-K72 VanDerWaalsContact C-N 3.35Å; V70-K72 PolarHBondContact O-N 3.09Å; K72-L74 VanDerWaalsContact C-N 3.28Å; K72-L74 PolarHBondContact O-N 3.13Å; K72-I75 WeakPolarHBondContact O-CB 3.29Å; K72-I75 PolarHBondContact O-N 3.28Å; K72-I75 VanDerWaalsContact O-N 3.1Å; K72-I76 WeakPolarHBondContact O-CG1 3.27Å; K72-I76 PolarHBondContact O-N 2.88Å
73	S	93.3	Very high	87.5	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.007	40%	0.399	C	S	.	.	H	α-helix	trans	-59.5	-39.6	177.2	78.5	0	0	0	0	112	E69 V70 G71 I75 I76 R77	E69-S73 PolarHBondContact O-N 3.12Å; V70-S73 WeakPolarHBondContact O-CB 3.48Å; V70-S73 PolarHBondContact O-N 2.9Å; V70-S73 VanDerWaalsContact O-N 3.14Å; V70-S73 PolarHBondContact O-OG 2.72Å; G71-S73 PolarHBondContact O-N 3.04Å; S73-I75 VanDerWaalsContact C-N 3.31Å; S73-I75 PolarHBondContact O-N 3.32Å; S73-I76 PolarHBondContact O-N 3.47Å; S73-R77 PolarHBondContact O-N 2.99Å
74	L	92.1	Very high	86.6	Confident	59 Å²	59	76.4 Å²	76.4	31%	0.309	40%	0.396	S	S	.	.	H	α-helix	trans	-64.5	-33.4	176	-63.3	177.2	0	0	0	112.8	V70 G71 K72 R77 R78	V70-L74 WeakPolarHBondContact O-CG 3.24Å; V70-L74 PolarHBondContact O-N 2.94Å; V70-L74 VanDerWaalsContact O-N 3.16Å; G71-L74 WeakPolarHBondContact O-CB 3.29Å; G71-L74 PolarHBondContact O-N 3.49Å; K72-L74 VanDerWaalsContact C-N 3.28Å; K72-L74 PolarHBondContact O-N 3.13Å; L74-R77 WeakPolarHBondContact O-CG 3.25Å; L74-R78 VanDerWaalsContact O-CG 3.32Å; L74-R78 WeakPolarHBondContact O-CG 3.41Å
75	I	90.8	Very high	86.2	Confident	100 Å²	100	79.4 Å²	79.4	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-72	-42.4	175.4	-66	163.9	0	0	0	110.3	G71 K72 S73 R78 K79	G71-I75 WeakPolarHBondContact O-CG1 3.24Å; G71-I75 PolarHBondContact O-N 2.89Å; K72-I75 WeakPolarHBondContact O-CB 3.29Å; K72-I75 PolarHBondContact O-N 3.28Å; K72-I75 VanDerWaalsContact O-N 3.1Å; S73-I75 VanDerWaalsContact C-N 3.31Å; S73-I75 PolarHBondContact O-N 3.32Å; I75-R78 PolarHBondContact O-N 3.49Å; I75-K79 PolarHBondContact O-N 3.33Å
76	I	87.7	Confident	86	Confident	33 Å²	33	75.4 Å²	75.4	17%	0.169	39%	0.386	C	S	.	.	H	α-helix	trans	-63.2	-47.2	-179.1	-67.4	166.9	0	0	0	110.7	H55 I57 K72 S73 R78 K79 I405	H55-I76 HydrophobicContact CB-CD1 4.3Å; I57-I76 HydrophobicContact CD1-CD1 3.81Å; I57-I76 HydrophobicContact CG1-CD1 3.53Å; K72-I76 WeakPolarHBondContact O-CG1 3.27Å; K72-I76 PolarHBondContact O-N 2.88Å; S73-I76 PolarHBondContact O-N 3.47Å; I76-R78 PolarHBondContact O-N 2.59Å; I76-K79 WeakPolarHBondContact O-CB 3.41Å; I76-K79 PolarHBondContact O-N 2.91Å; I76-I405 HydrophobicContact CB-CD1 4.45Å; I76-I405 HydrophobicContact CB-CG1 4.44Å; I76-I405 HydrophobicContact CD1-CD1 3.96Å; I76-I405 HydrophobicContact CD1-CG1 4.47Å; I76-I405 HydrophobicContact CG2-CD1 3.99Å; I76-I405 HydrophobicContact CG2-CG1 4.27Å
77	R	85.8	Confident	85.9	Confident	70 Å²	70	76.2 Å²	76.2	26%	0.264	39%	0.388	S	S	.	.	H	α-helix	trans	-65.7	-20.7	179.9	75.6	-178.7	-164.5	179.1	8.1	114.1	S73 L74 S369 D403	S73-R77 PolarHBondContact O-N 2.99Å; L74-R77 WeakPolarHBondContact O-CG 3.25Å; R77-S369 PolarHBondContact NH1-O 2.95Å; R77-S369 PolarHBondContact NH2-O 3.23Å; R77-D403 IonicContact NH1-OD2 3.9Å
78	R	82.8	Confident	85.6	Confident	209 Å²	209	77.5 Å²	77.5	79%	0.789	38%	0.379	S	S	*	.	H	α-helix	trans	-78.1	-23.8	174	-77	175.7	-179.7	-178.9	2.4	112.7	L74 I75 I76	L74-R78 VanDerWaalsContact O-CG 3.32Å; L74-R78 WeakPolarHBondContact O-CG 3.41Å; I75-R78 PolarHBondContact O-N 3.49Å; I76-R78 PolarHBondContact O-N 2.59Å
79	K	79.2	Confident	85.5	Confident	144 Å²	144	73 Å²	73	63%	0.626	35%	0.352	S	S	*	.	S	Bend	trans	-73.4	145	170.3	-63	-179.4	179.7	-177.7	0	107.7	I75 I76 V81	I75-K79 PolarHBondContact O-N 3.33Å; I76-K79 WeakPolarHBondContact O-CB 3.41Å; I76-K79 PolarHBondContact O-N 2.91Å; K79-V81 PolarHBondContact O-N 3.42Å
80	T	61.8	Low	85.5	Confident	135 Å²	135	74.7 Å²	74.7	83%	0.828	36%	0.361	S	S	*	.			trans	-55.3	107.6	178.8	-52	0	0	0	0	109.6	V82	T80-V82 PolarHBondContact O-N 3.27Å
81	V	65.6	Low	85.5	Confident	37 Å²	37	79.5 Å²	79.5	22%	0.224	39%	0.386	C	S	.	.			trans	-71.8	114	173.2	-175.9	0	0	0	0	106.6	K79 E83 P400 P404	K79-V81 PolarHBondContact O-N 3.42Å; V81-E83 PolarHBondContact O-N 3.48Å; V81-P400 WeakPolarHBondContact CG1-O 3.48Å; V81-P404 HydrophobicContact CG1-CB 4.26Å; V81-P404 HydrophobicContact CG1-CG 4.02Å; V81-P404 HydrophobicContact CG2-CG 3.89Å
82	V	64.6	Low	85.4	Confident	107 Å²	107	78.7 Å²	78.7	65%	0.648	37%	0.374	S	S	*	.			trans	-71.6	112.4	175.7	-177.4	0	0	0	0	107.3	T80	T80-V82 PolarHBondContact O-N 3.27Å
83	E	68.1	Low	85.5	Confident	73 Å²	73	74.7 Å²	74.7	34%	0.341	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-70.5	130.2	172	-176.8	175	-130.3	0	0	109.2	V81 K85 N128 K401	V81-E83 PolarHBondContact O-N 3.48Å; E83-K85 PolarHBondContact O-N 3.42Å; E83-N128 PolarHBondContact OE1-OD1 3.3Å; E83-K401 WeakPolarHBondContact OE1-CE 3.33Å; E83-K401 IonicContact OE1-NZ 2.63Å; E83-K401 PolarHBondContact OE1-NZ 3.4Å; E83-K401 WeakPolarHBondContact OE2-CE 3.27Å; E83-K401 IonicContact OE2-NZ 3.77Å; E83-K401 PolarHBondContact OE2-NZ 2.93Å
84	D	79.4	Confident	85.7	Confident	29 Å²	29	78 Å²	78	16%	0.155	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-68.9	123.3	170.6	-74.5	-61.5	0	0	0	109.7	R88 W130	D84-R88 IonicContact OD1-CZ 2.74Å; D84-R88 IonicContact OD1-NH1 2.79Å; D84-R88 PolarHBondContact OD1-NH1 3.29Å; D84-W130 HydrophobicContact CB-CB 4.4Å; D84-W130 HydrophobicContact CB-CD2 4.2Å; D84-W130 HydrophobicContact CB-CG 3.71Å
85	K	88.8	Confident	85.9	Confident	144 Å²	144	79.1 Å²	79.1	63%	0.626	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-67.3	144.9	178.6	-58.4	-174.3	178.8	178.3	0	110.5	E83 E87 R88 W130	E83-K85 PolarHBondContact O-N 3.42Å; K85-E87 WeakPolarHBondContact CB-OE2 3.26Å; K85-E87 PolarHBondContact O-N 2.94Å; K85-R88 WeakPolarHBondContact O-CB 3.27Å; K85-R88 PolarHBondContact O-N 3.26Å; K85-R88 VanDerWaalsContact O-N 3.09Å; K85-W130 PolarHBondContact O-NE1 3.38Å
86	D	92.9	Very high	86.3	Confident	23 Å²	23	75.6 Å²	75.6	12%	0.123	38%	0.382	C	S	.	.	H	α-helix	trans	-56.9	-34.5	179.9	-70.6	-15.9	0	0	0	111.5	R88 L89 I90 A129 Q157 F158	D86-R88 VanDerWaalsContact C-N 3.25Å; D86-R88 PolarHBondContact O-N 3.38Å; D86-L89 WeakPolarHBondContact O-CB 3.46Å; D86-L89 PolarHBondContact O-N 3.03Å; D86-I90 PolarHBondContact O-N 3.13Å; D86-A129 HydrophobicContact CB-CB 4.14Å; D86-A129 WeakPolarHBondContact OD1-CB 3.28Å; D86-A129 PolarHBondContact OD1-N 3.46Å; D86-Q157 HydrophobicContact CB-CB 4Å; D86-F158 WeakPolarHBondContact OD2-CA 3.26Å; D86-F158 WeakPolarHBondContact OD2-CB 3.46Å
87	E	94.3	Very high	86.7	Confident	81 Å²	81	77.8 Å²	77.8	38%	0.379	40%	0.399	S	S	.	.	H	α-helix	trans	-56.4	-36.5	177.9	-64.4	90.1	155.1	0	0	112.9	K85 L89 I90 D91 Q157	K85-E87 WeakPolarHBondContact CB-OE2 3.26Å; K85-E87 PolarHBondContact O-N 2.94Å; E87-L89 PolarHBondContact O-N 3.09Å; E87-I90 WeakPolarHBondContact O-CA 3.36Å; E87-I90 VanDerWaalsContact O-CB 3.31Å; E87-I90 WeakPolarHBondContact O-CB 3.37Å; E87-I90 PolarHBondContact O-N 3.19Å; E87-I90 VanDerWaalsContact O-N 3.09Å; E87-D91 PolarHBondContact O-N 2.97Å; E87-Q157 HydrophobicContact CG-CB 4.48Å; E87-Q157 HydrophobicContact CG-CG 3.9Å; E87-Q157 WeakPolarHBondContact OE1-CG 3.45Å
88	R	91.7	Very high	87.1	Confident	130 Å²	130	77.3 Å²	77.3	49%	0.491	40%	0.403	S	S	.	.	H	α-helix	trans	-63.3	-34.2	177.6	-69.9	-177.6	171.4	178.4	-4.8	112	D84 K85 D86 F92 W130	D84-R88 IonicContact OD1-CZ 2.74Å; D84-R88 IonicContact OD1-NH1 2.79Å; D84-R88 PolarHBondContact OD1-NH1 3.29Å; K85-R88 WeakPolarHBondContact O-CB 3.27Å; K85-R88 PolarHBondContact O-N 3.26Å; K85-R88 VanDerWaalsContact O-N 3.09Å; D86-R88 VanDerWaalsContact C-N 3.25Å; D86-R88 PolarHBondContact O-N 3.38Å; R88-F92 VanDerWaalsContact O-CB 3.3Å; R88-F92 WeakPolarHBondContact O-CB 3.46Å; R88-F92 PolarHBondContact O-N 2.89Å; R88-W130 HydrophobicContact CB-CZ2 4.15Å
89	L	94.5	Very high	87.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-73.3	-33.4	176.7	-173.4	58.1	0	0	0	111.1	D86 E87 F92 T93 F99 A129 W130 E133 A161 L165	D86-L89 WeakPolarHBondContact O-CB 3.46Å; D86-L89 PolarHBondContact O-N 3.03Å; E87-L89 PolarHBondContact O-N 3.09Å; L89-F92 PolarHBondContact O-N 3.29Å; L89-T93 HydrophobicContact CD1-CG2 4.05Å; L89-T93 HydrophobicContact CG-CG2 4.39Å; L89-T93 WeakPolarHBondContact O-CB 3.47Å; L89-T93 WeakPolarHBondContact O-CG2 3.31Å; L89-T93 PolarHBondContact O-N 3.32Å; L89-T93 PolarHBondContact O-OG1 3.22Å; L89-F99 HydrophobicContact CD1-CE2 3.85Å; L89-A129 HydrophobicContact CD2-CB 3.85Å; L89-W130 HydrophobicContact CB-CD2 4.38Å; L89-W130 HydrophobicContact CB-CZ2 4.1Å; L89-W130 HydrophobicContact CD1-CE3 4.37Å; L89-W130 HydrophobicContact CD1-CH2 4.11Å; L89-W130 HydrophobicContact CD1-CZ2 4.22Å; L89-W130 HydrophobicContact CD1-CZ3 4.16Å; L89-E133 HydrophobicContact CD1-CG 4.29Å; L89-E133 HydrophobicContact CD2-CB 4.01Å; L89-A161 HydrophobicContact CB-CB 4.3Å; L89-A161 HydrophobicContact CD2-CB 4.23Å; L89-A161 HydrophobicContact CG-CB 4.39Å; L89-L165 HydrophobicContact CD1-CD2 4.13Å; L89-L165 HydrophobicContact CD2-CD1 4.07Å; L89-L165 HydrophobicContact CD2-CD2 4.12Å; L89-L165 HydrophobicContact CD2-CG 4.09Å; L89-L165 HydrophobicContact CG-CD2 4.41Å
90	I	96.9	Very high	88.6	Confident	51 Å²	51	63.7 Å²	63.7	26%	0.262	35%	0.348	S	S	.	.	H	α-helix	trans	-59.5	-53.5	171.5	-54.4	172.6	0	0	0	109.7	D86 E87 F92 T93 G94 Q157 A160 A161	D86-I90 PolarHBondContact O-N 3.13Å; E87-I90 WeakPolarHBondContact O-CA 3.36Å; E87-I90 VanDerWaalsContact O-CB 3.31Å; E87-I90 WeakPolarHBondContact O-CB 3.37Å; E87-I90 PolarHBondContact O-N 3.19Å; E87-I90 VanDerWaalsContact O-N 3.09Å; I90-F92 VanDerWaalsContact C-N 3.26Å; I90-F92 PolarHBondContact O-N 3.47Å; I90-T93 PolarHBondContact O-N 3.48Å; I90-T93 PolarHBondContact O-OG1 2.98Å; I90-G94 PolarHBondContact O-N 3.44Å; I90-Q157 HydrophobicContact CD1-CB 4.38Å; I90-A160 HydrophobicContact CD1-CB 3.63Å; I90-A160 HydrophobicContact CG1-CB 4.05Å; I90-A161 HydrophobicContact CG1-CB 3.97Å
91	D	95.1	Very high	90.1	Very high	125 Å²	125	64.4 Å²	64.4	67%	0.668	34%	0.339	S	S	*	.	H	α-helix	trans	-58.8	-42.2	-179.1	-65.4	-23.1	0	0	0	111.1	E87 G94	E87-D91 PolarHBondContact O-N 2.97Å; D91-G94 PolarHBondContact O-N 2.88Å
92	F	93.8	Very high	91.4	Very high	10 Å²	10	66.3 Å²	66.3	4%	0.044	35%	0.348	C	S	.	.	H	α-helix	trans	-68.8	-43	-178	-163.5	-171.9	0	0	0	112.7	I48 R88 L89 I90 G94 N95 V98 F99 I102 R103 W130	I48-F92 HydrophobicContact CG2-CD2 4.43Å; R88-F92 VanDerWaalsContact O-CB 3.3Å; R88-F92 WeakPolarHBondContact O-CB 3.46Å; R88-F92 PolarHBondContact O-N 2.89Å; L89-F92 PolarHBondContact O-N 3.29Å; I90-F92 VanDerWaalsContact C-N 3.26Å; I90-F92 PolarHBondContact O-N 3.47Å; F92-G94 PolarHBondContact O-N 3.36Å; F92-N95 PolarHBondContact O-N 3.01Å; F92-V98 HydrophobicContact CE2-CG1 4.29Å; F92-F99 HydrophobicContact CB-CD2 4.46Å; F92-F99 AromaticContact CD1-CD2 3.68Å; F92-F99 HydrophobicContact CD1-CD2 3.68Å; F92-F99 HydrophobicContact CD1-CE2 4.24Å; F92-F99 HydrophobicContact CD2-CB 4.13Å; F92-F99 HydrophobicContact CD2-CD2 4.23Å; F92-F99 HydrophobicContact CE1-CD2 4Å; F92-F99 HydrophobicContact CE2-CB 4.25Å; F92-F99 HydrophobicContact CE2-CD2 4.48Å; F92-F99 AromaticContact CG-CD2 3.84Å; F92-F99 HydrophobicContact CG-CD2 3.84Å; F92-F99 HydrophobicContact CZ-CD2 4.38Å; F92-I102 HydrophobicContact CE1-CG2 4.46Å; F92-I102 HydrophobicContact CE2-CB 4.34Å; F92-I102 HydrophobicContact CE2-CD1 4.04Å; F92-I102 HydrophobicContact CZ-CB 3.74Å; F92-I102 HydrophobicContact CZ-CD1 4.08Å; F92-I102 HydrophobicContact CZ-CG1 4.49Å; F92-I102 HydrophobicContact CZ-CG2 3.67Å; F92-R103 HydrophobicContact CE1-CG 3.95Å; F92-R103 HydrophobicContact CZ-CG 4.36Å; F92-W130 AromaticContact CD1-CH2 3.82Å; F92-W130 HydrophobicContact CD1-CH2 3.82Å; F92-W130 HydrophobicContact CE1-CH2 4.32Å
93	T	97.2	Very high	92.8	Very high	8 Å²	8	62.4 Å²	62.4	5%	0.049	32%	0.321	C	S	.	.	H	α-helix	trans	-72.2	-8.3	175.6	54.8	0	0	0	0	113.1	L89 I90 N95 F99 G164 L165 C168	L89-T93 HydrophobicContact CD1-CG2 4.05Å; L89-T93 HydrophobicContact CG-CG2 4.39Å; L89-T93 WeakPolarHBondContact O-CB 3.47Å; L89-T93 WeakPolarHBondContact O-CG2 3.31Å; L89-T93 PolarHBondContact O-N 3.32Å; L89-T93 PolarHBondContact O-OG1 3.22Å; I90-T93 PolarHBondContact O-N 3.48Å; I90-T93 PolarHBondContact O-OG1 2.98Å; T93-N95 PolarHBondContact O-N 3.04Å; T93-F99 HydrophobicContact CG2-CD1 4.27Å; T93-F99 HydrophobicContact CG2-CD2 3.92Å; T93-F99 HydrophobicContact CG2-CE1 4.26Å; T93-F99 HydrophobicContact CG2-CE2 3.9Å; T93-F99 HydrophobicContact CG2-CG 4.11Å; T93-F99 HydrophobicContact CG2-CZ 4.08Å; T93-G164 WeakPolarHBondContact OG1-CA 3.3Å; T93-L165 HydrophobicContact CG2-CD2 4.12Å; T93-C168 PolarHBondContact O-SG 3.25Å
94	G	96.8	Very high	94	Very high	70 Å²	70	59.9 Å²	59.9	72%	0.722	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.9	168.2	0	0	0	0	0	114	I90 D91 F92	I90-G94 PolarHBondContact O-N 3.44Å; D91-G94 PolarHBondContact O-N 2.88Å; F92-G94 PolarHBondContact O-N 3.36Å
95	N	96.9	Very high	94.7	Very high	82 Å²	82	59 Å²	59	44%	0.439	31%	0.31	S	S	.	.	S	Bend	trans	-127	84.7	172	-171.8	-27.4	0	0	0	110.5	F92 T93 P97 V98 F99	F92-N95 PolarHBondContact O-N 3.01Å; T93-N95 PolarHBondContact O-N 3.04Å; N95-P97 WeakPolarHBondContact OD1-CD 3.47Å; N95-V98 HydrophobicContact CB-CB 4.22Å; N95-V98 HydrophobicContact CB-CG2 4.47Å; N95-V98 WeakPolarHBondContact ND2-CG2 3.44Å; N95-V98 PolarHBondContact O-N 3.05Å; N95-V98 VanDerWaalsContact O-N 3.11Å; N95-V98 WeakPolarHBondContact OD1-CG2 3.44Å; N95-V98 PolarHBondContact OD1-N 2.86Å; N95-F99 WeakPolarHBondContact O-CB 3.32Å; N95-F99 PolarHBondContact O-N 3.27Å
96	C	97.6	Very high	94.8	Very high	26 Å²	26	55.1 Å²	55.1	18%	0.176	30%	0.296	C	S	.	.	H	α-helix	trans	-55.9	-43.7	-174.8	-63.5	0	0	0	0	115.1	V98 F99 R100 C168	C96-V98 VanDerWaalsContact C-N 3.32Å; C96-V98 PolarHBondContact O-N 3.15Å; C96-F99 PolarHBondContact O-N 3.12Å; C96-R100 WeakPolarHBondContact O-CB 3.39Å; C96-R100 WeakPolarHBondContact O-CG 3.18Å; C96-R100 PolarHBondContact O-N 3.14Å; C96-C168 WeakPolarHBondContact CA-SG 3.4Å; C96-C168 HydrophobicContact CB-CB 3.61Å; C96-C168 WeakPolarHBondContact CB-SG 3.47Å; C96-C168 WeakPolarHBondContact SG-CA 3.26Å; C96-C168 WeakPolarHBondContact SG-CB 3.47Å; C96-C168 CovalentContact SG-SG 2.05Å; C96-C168 PolarHBondContact SG-SG 3.44Å
97	P	96.8	Very high	94.6	Very high	80 Å²	80	59.5 Å²	59.5	52%	0.519	32%	0.319	S	S	.	.	H	α-helix	trans	-57.5	-42.3	174.8	-26.9	35.1	0	0	0	113.3	N95 K101	N95-P97 WeakPolarHBondContact OD1-CD 3.47Å; P97-K101 VanDerWaalsContact O-CB 3.3Å; P97-K101 WeakPolarHBondContact O-CB 3.41Å; P97-K101 PolarHBondContact O-N 2.68Å; P97-K101 VanDerWaalsContact O-N 3.16Å
98	V	95.6	Very high	94.4	Very high	59 Å²	59	58.5 Å²	58.5	36%	0.358	32%	0.316	S	S	.	.	H	α-helix	trans	-70.6	-43.7	178.3	174.7	0	0	0	0	111	F92 N95 C96 K101 I102	F92-V98 HydrophobicContact CE2-CG1 4.29Å; N95-V98 HydrophobicContact CB-CB 4.22Å; N95-V98 HydrophobicContact CB-CG2 4.47Å; N95-V98 WeakPolarHBondContact ND2-CG2 3.44Å; N95-V98 PolarHBondContact O-N 3.05Å; N95-V98 VanDerWaalsContact O-N 3.11Å; N95-V98 WeakPolarHBondContact OD1-CG2 3.44Å; N95-V98 PolarHBondContact OD1-N 2.86Å; C96-V98 VanDerWaalsContact C-N 3.32Å; C96-V98 PolarHBondContact O-N 3.15Å; V98-K101 PolarHBondContact O-N 3.05Å; V98-I102 HydrophobicContact CG1-CD1 3.61Å; V98-I102 HydrophobicContact CG1-CG1 4.32Å; V98-I102 WeakPolarHBondContact O-CB 3.39Å; V98-I102 WeakPolarHBondContact O-CG1 3.21Å; V98-I102 PolarHBondContact O-N 3.16Å
99	F	95.9	Very high	94.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-56.4	-54.2	175.3	169.2	-101.6	0	0	0	111.7	L89 F92 T93 N95 C96 K101 I102 R103 Y105 E133 L165 C168	L89-F99 HydrophobicContact CD1-CE2 3.85Å; F92-F99 HydrophobicContact CB-CD2 4.46Å; F92-F99 AromaticContact CD1-CD2 3.68Å; F92-F99 HydrophobicContact CD1-CD2 3.68Å; F92-F99 HydrophobicContact CD1-CE2 4.24Å; F92-F99 HydrophobicContact CD2-CB 4.13Å; F92-F99 HydrophobicContact CD2-CD2 4.23Å; F92-F99 HydrophobicContact CE1-CD2 4Å; F92-F99 HydrophobicContact CE2-CB 4.25Å; F92-F99 HydrophobicContact CE2-CD2 4.48Å; F92-F99 AromaticContact CG-CD2 3.84Å; F92-F99 HydrophobicContact CG-CD2 3.84Å; F92-F99 HydrophobicContact CZ-CD2 4.38Å; T93-F99 HydrophobicContact CG2-CD1 4.27Å; T93-F99 HydrophobicContact CG2-CD2 3.92Å; T93-F99 HydrophobicContact CG2-CE1 4.26Å; T93-F99 HydrophobicContact CG2-CE2 3.9Å; T93-F99 HydrophobicContact CG2-CG 4.11Å; T93-F99 HydrophobicContact CG2-CZ 4.08Å; N95-F99 WeakPolarHBondContact O-CB 3.32Å; N95-F99 PolarHBondContact O-N 3.27Å; C96-F99 PolarHBondContact O-N 3.12Å; F99-K101 VanDerWaalsContact C-N 3.34Å; F99-K101 PolarHBondContact O-N 3.37Å; F99-I102 PolarHBondContact O-N 3.1Å; F99-R103 HydrophobicContact CD2-CG 3.73Å; F99-R103 HydrophobicContact CE2-CG 3.53Å; F99-R103 HydrophobicContact CG-CG 4.42Å; F99-R103 HydrophobicContact CZ-CG 4.06Å; F99-R103 VanDerWaalsContact O-CB 3.27Å; F99-R103 WeakPolarHBondContact O-CB 3.4Å; F99-R103 VanDerWaalsContact O-CG 3.28Å; F99-R103 WeakPolarHBondContact O-CG 3.49Å; F99-R103 PolarHBondContact O-N 3.23Å; F99-Y105 AromaticContact CE1-CD2 3.96Å; F99-Y105 HydrophobicContact CE1-CD2 3.96Å; F99-Y105 AromaticContact CE1-CE2 3.66Å; F99-Y105 HydrophobicContact CE1-CE2 3.66Å; F99-Y105 HydrophobicContact CZ-CD2 4.33Å; F99-Y105 AromaticContact CZ-CE2 3.64Å; F99-Y105 HydrophobicContact CZ-CE2 3.64Å; F99-E133 HydrophobicContact CE2-CG 4.42Å; F99-E133 HydrophobicContact CZ-CG 4.18Å; F99-L165 HydrophobicContact CE1-CD2 4.24Å; F99-L165 HydrophobicContact CE2-CD2 4.28Å; F99-L165 HydrophobicContact CZ-CD2 3.56Å; F99-C168 HydrophobicContact CD1-CB 3.88Å; F99-C168 HydrophobicContact CE1-CB 4.21Å
100	R	96.5	Very high	93.9	Very high	67 Å²	67	53.8 Å²	53.8	25%	0.253	30%	0.303	S	S	.	.	H	α-helix	trans	-61.3	-42.4	-177.6	-73.1	-161	-58.6	-109.7	0.6	112.4	C96 G104 Y105 D106 C168 L169	C96-R100 WeakPolarHBondContact O-CB 3.39Å; C96-R100 WeakPolarHBondContact O-CG 3.18Å; C96-R100 PolarHBondContact O-N 3.14Å; R100-G104 PolarHBondContact O-N 2.76Å; R100-Y105 PolarHBondContact O-N 3.25Å; R100-D106 WeakPolarHBondContact CB-OD1 3.29Å; R100-D106 WeakPolarHBondContact CB-OD2 3.4Å; R100-D106 WeakPolarHBondContact CD-OD1 3.38Å; R100-D106 IonicContact NE-OD1 3.75Å; R100-D106 PolarHBondContact NE-OD1 2.97Å; R100-D106 VanDerWaalsContact NE-OD1 3.11Å; R100-D106 IonicContact NE-OD2 3.75Å; R100-C168 WeakPolarHBondContact CD-O 3.5Å; R100-C168 PolarHBondContact NH1-O 3.14Å; R100-L169 HydrophobicContact CG-CD2 4.13Å
101	K	94.3	Very high	93.6	Very high	150 Å²	150	51.4 Å²	51.4	65%	0.652	29%	0.29	S	S	*	.	H	α-helix	trans	-64	-50.5	177.1	-174.3	172	-175	170	0	112.3	P97 V98 F99 R103 G104	P97-K101 VanDerWaalsContact O-CB 3.3Å; P97-K101 WeakPolarHBondContact O-CB 3.41Å; P97-K101 PolarHBondContact O-N 2.68Å; P97-K101 VanDerWaalsContact O-N 3.16Å; V98-K101 PolarHBondContact O-N 3.05Å; F99-K101 VanDerWaalsContact C-N 3.34Å; F99-K101 PolarHBondContact O-N 3.37Å; K101-R103 PolarHBondContact O-N 3.25Å; K101-G104 PolarHBondContact O-N 3.47Å
102	I	92.9	Very high	93.4	Very high	78 Å²	78	50 Å²	50	40%	0.4	28%	0.28	S	S	.	.	H	α-helix	trans	-69.4	-35.8	-177.4	-67.5	176.4	0	0	0	111.6	F92 V98 F99 G104	F92-I102 HydrophobicContact CE1-CG2 4.46Å; F92-I102 HydrophobicContact CE2-CB 4.34Å; F92-I102 HydrophobicContact CE2-CD1 4.04Å; F92-I102 HydrophobicContact CZ-CB 3.74Å; F92-I102 HydrophobicContact CZ-CD1 4.08Å; F92-I102 HydrophobicContact CZ-CG1 4.49Å; F92-I102 HydrophobicContact CZ-CG2 3.67Å; V98-I102 HydrophobicContact CG1-CD1 3.61Å; V98-I102 HydrophobicContact CG1-CG1 4.32Å; V98-I102 WeakPolarHBondContact O-CB 3.39Å; V98-I102 WeakPolarHBondContact O-CG1 3.21Å; V98-I102 PolarHBondContact O-N 3.16Å; F99-I102 PolarHBondContact O-N 3.1Å; I102-G104 PolarHBondContact O-N 3.02Å
103	R	92.4	Very high	93.3	Very high	24 Å²	24	52.5 Å²	52.5	9%	0.091	29%	0.292	C	S	.	.	H	α-helix	trans	-80.2	-4.2	176.6	-61.6	-54.3	-63.1	167.6	-9.8	113.4	F52 F92 F99 K101 Y105 E133 R137	F52-R103 VanDerWaalsContact CE2-NH2 3.34Å; F92-R103 HydrophobicContact CE1-CG 3.95Å; F92-R103 HydrophobicContact CZ-CG 4.36Å; F99-R103 HydrophobicContact CD2-CG 3.73Å; F99-R103 HydrophobicContact CE2-CG 3.53Å; F99-R103 HydrophobicContact CG-CG 4.42Å; F99-R103 HydrophobicContact CZ-CG 4.06Å; F99-R103 VanDerWaalsContact O-CB 3.27Å; F99-R103 WeakPolarHBondContact O-CB 3.4Å; F99-R103 VanDerWaalsContact O-CG 3.28Å; F99-R103 WeakPolarHBondContact O-CG 3.49Å; F99-R103 PolarHBondContact O-N 3.23Å; K101-R103 PolarHBondContact O-N 3.25Å; R103-Y105 VanDerWaalsContact C-N 3.33Å; R103-Y105 HydrophobicContact CB-CD2 3.58Å; R103-Y105 HydrophobicContact CB-CE2 3.61Å; R103-Y105 HydrophobicContact CG-CE2 4.32Å; R103-Y105 PolarHBondContact O-N 3.01Å; R103-E133 IonicContact CZ-OE1 3.95Å; R103-E133 IonicContact CZ-OE2 2.89Å; R103-E133 IonicContact NE-OE1 2.69Å; R103-E133 PolarHBondContact NE-OE1 3.4Å; R103-E133 IonicContact NE-OE2 2.71Å; R103-E133 IonicContact NH2-OE1 3.52Å; R103-E133 PolarHBondContact NH2-OE1 3.32Å; R103-E133 IonicContact NH2-OE2 3.46Å; R103-E133 PolarHBondContact NH2-OE2 3.26Å; R103-R137 WeakPolarHBondContact O-CD 3.43Å
104	G	92.8	Very high	93.1	Very high	21 Å²	21	52.2 Å²	52.2	22%	0.216	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	19.6	176.2	0	0	0	0	0	114.5	R100 K101 I102 D106 D107	R100-G104 PolarHBondContact O-N 2.76Å; K101-G104 PolarHBondContact O-N 3.47Å; I102-G104 PolarHBondContact O-N 3.02Å; G104-D106 VanDerWaalsContact C-N 3.28Å; G104-D107 PolarHBondContact O-N 3.29Å
105	Y	94.9	Very high	93	Very high	11 Å²	11	51.5 Å²	51.5	4%	0.043	27%	0.267	C	S	.	.	S	Bend	trans	-68.4	-30.5	174.3	-73.4	-75.3	0	0	0	112.1	F99 R100 R103 D107 E133 R137 Y140 L169	F99-Y105 AromaticContact CE1-CD2 3.96Å; F99-Y105 HydrophobicContact CE1-CD2 3.96Å; F99-Y105 AromaticContact CE1-CE2 3.66Å; F99-Y105 HydrophobicContact CE1-CE2 3.66Å; F99-Y105 HydrophobicContact CZ-CD2 4.33Å; F99-Y105 AromaticContact CZ-CE2 3.64Å; F99-Y105 HydrophobicContact CZ-CE2 3.64Å; R100-Y105 PolarHBondContact O-N 3.25Å; R103-Y105 VanDerWaalsContact C-N 3.33Å; R103-Y105 HydrophobicContact CB-CD2 3.58Å; R103-Y105 HydrophobicContact CB-CE2 3.61Å; R103-Y105 HydrophobicContact CG-CE2 4.32Å; R103-Y105 PolarHBondContact O-N 3.01Å; Y105-D107 VanDerWaalsContact C-N 3.35Å; Y105-E133 PolarHBondContact OH-OE1 3.15Å; Y105-R137 HydrophobicContact CE1-CB 4.31Å; Y105-R137 HydrophobicContact CE1-CG 4.42Å; Y105-Y140 AromaticContact CD1-CD1 3.64Å; Y105-Y140 HydrophobicContact CD1-CD1 3.64Å; Y105-Y140 AromaticContact CD1-CD2 4Å; Y105-Y140 HydrophobicContact CD1-CD2 4Å; Y105-Y140 AromaticContact CD1-CE1 3.88Å; Y105-Y140 HydrophobicContact CD1-CE1 3.88Å; Y105-Y140 HydrophobicContact CD1-CE2 4.22Å; Y105-Y140 AromaticContact CD1-CG 3.66Å; Y105-Y140 HydrophobicContact CD1-CG 3.66Å; Y105-Y140 HydrophobicContact CE1-CD1 4.14Å; Y105-Y140 AromaticContact CE1-CD2 3.83Å; Y105-Y140 HydrophobicContact CE1-CD2 3.83Å; Y105-Y140 HydrophobicContact CE1-CE2 4.38Å; Y105-Y140 AromaticContact CE1-CG 3.66Å; Y105-Y140 HydrophobicContact CE1-CG 3.66Å; Y105-L169 HydrophobicContact CD1-CD1 4.35Å; Y105-L169 HydrophobicContact CD1-CD2 3.65Å; Y105-L169 HydrophobicContact CD2-CD2 3.91Å; Y105-L169 HydrophobicContact CE1-CD1 3.84Å; Y105-L169 HydrophobicContact CE1-CD2 4Å; Y105-L169 HydrophobicContact CE2-CD1 4.35Å; Y105-L169 HydrophobicContact CE2-CD2 4.25Å; Y105-L169 HydrophobicContact CG-CD2 3.6Å
106	D	91.9	Very high	92.9	Very high	62 Å²	62	52.8 Å²	52.8	33%	0.332	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-12	179.6	-68.1	-22	0	0	0	112.6	R100 G104 P430	R100-D106 WeakPolarHBondContact CB-OD1 3.29Å; R100-D106 WeakPolarHBondContact CB-OD2 3.4Å; R100-D106 WeakPolarHBondContact CD-OD1 3.38Å; R100-D106 IonicContact NE-OD1 3.75Å; R100-D106 PolarHBondContact NE-OD1 2.97Å; R100-D106 VanDerWaalsContact NE-OD1 3.11Å; R100-D106 IonicContact NE-OD2 3.75Å; G104-D106 VanDerWaalsContact C-N 3.28Å; D106-P430 WeakPolarHBondContact O-CG 3.46Å
107	D	88.4	Confident	92.9	Very high	115 Å²	115	52.6 Å²	52.6	62%	0.615	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	11.5	-174.6	-62.5	-44.2	0	0	0	113.5	G104 Y105 C109	G104-D107 PolarHBondContact O-N 3.29Å; Y105-D107 VanDerWaalsContact C-N 3.35Å; D107-C109 PolarHBondContact O-N 3.32Å
108	L	88.5	Confident	92.9	Very high	59 Å²	59	49.7 Å²	49.7	31%	0.309	25%	0.25	S	C	.	.			trans	-83.2	115.1	-172.4	-64.8	172	0	0	0	112.1	Y140 P430	L108-Y140 HydrophobicContact CD1-CD1 3.36Å; L108-Y140 HydrophobicContact CD1-CE1 3.9Å; L108-Y140 HydrophobicContact CD1-CG 4.44Å; L108-P430 WeakPolarHBondContact O-CD 3.43Å
109	C	86.7	Confident	93.1	Very high	26 Å²	26	46.9 Å²	46.9	18%	0.176	23%	0.233	C	C	.	.			trans	-86.8	133.1	169.4	-58.4	0	0	0	0	111	D107 Q422 L427 C429	D107-C109 PolarHBondContact O-N 3.32Å; C109-Q422 PolarHBondContact O-NE2 3.49Å; C109-Q422 VanDerWaalsContact O-NE2 3.16Å; C109-L427 HydrophobicContact CB-CB 4.37Å; C109-L427 HydrophobicContact CB-CD1 4.2Å; C109-C429 HydrophobicContact CB-CB 4.09Å; C109-C429 WeakPolarHBondContact CB-SG 3.32Å; C109-C429 WeakPolarHBondContact SG-CB 3.33Å; C109-C429 CovalentContact SG-SG 2.04Å; C109-C429 PolarHBondContact SG-SG 3.29Å
110	V	89.4	Confident	93.2	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.3	-179.5	-170	0	0	0	0	109.7	E114 K115 P142 T428	V110-E114 HydrophobicContact CG1-CB 3.43Å; V110-E114 VanDerWaalsContact CG1-CB 3.43Å; V110-E114 HydrophobicContact CG1-CG 4.46Å; V110-K115 HydrophobicContact CB-CG 4.43Å; V110-K115 HydrophobicContact CG1-CG 3.89Å; V110-P142 HydrophobicContact CG2-CG 3.62Å; V110-T428 PolarHBondContact N-O 3.47Å; V110-T428 PolarHBondContact O-N 3.23Å
111	S	90.2	Very high	93.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	162.4	172.7	65.9	0	0	0	0	112.7	E113 E114 K115 M223	S111-E113 PolarHBondContact O-N 3.49Å; S111-E114 WeakPolarHBondContact CB-OE2 3.3Å; S111-E114 PolarHBondContact N-OE2 2.9Å; S111-E114 PolarHBondContact O-N 2.98Å; S111-E114 WeakPolarHBondContact OG-CB 3.48Å; S111-E114 VanDerWaalsContact OG-CG 3.25Å; S111-E114 WeakPolarHBondContact OG-CG 3.45Å; S111-E114 PolarHBondContact OG-N 3.32Å; S111-E114 VanDerWaalsContact OG-N 3.09Å; S111-E114 PolarHBondContact OG-OE2 2.98Å; S111-K115 WeakPolarHBondContact O-CG 3.44Å; S111-K115 PolarHBondContact O-N 2.71Å; S111-M223 WeakPolarHBondContact OG-CE 3.49Å
112	E	90.9	Very high	93.5	Very high	97 Å²	97	36.6 Å²	36.6	45%	0.453	19%	0.19	S	C	.	.	H	α-helix	trans	-60.6	-34.9	172.4	-67	-53.2	124.9	0	0	112.6	K115 I116 T428	E112-K115 PolarHBondContact O-N 2.77Å; E112-K115 WeakPolarHBondContact OE1-CE 3.42Å; E112-K115 IonicContact OE1-NZ 2.81Å; E112-K115 PolarHBondContact OE1-NZ 2.72Å; E112-K115 IonicContact OE2-NZ 3.24Å; E112-I116 WeakPolarHBondContact O-CG1 3.3Å; E112-I116 PolarHBondContact O-N 3.29Å; E112-I116 VanDerWaalsContact O-N 3.1Å; E112-T428 PolarHBondContact OE1-OG1 3.15Å
113	E	91.8	Very high	93.8	Very high	61 Å²	61	32.9 Å²	32.9	29%	0.285	17%	0.171	S	C	.	.	H	α-helix	trans	-62.8	-46.2	177	170.6	158.7	-153.3	0	0	112.4	S111 K115 I116 F117 M223 V226 R230	S111-E113 PolarHBondContact O-N 3.49Å; E113-K115 VanDerWaalsContact C-N 3.34Å; E113-I116 WeakPolarHBondContact O-CG1 3.43Å; E113-I116 PolarHBondContact O-N 3.14Å; E113-F117 WeakPolarHBondContact O-CB 3.45Å; E113-F117 PolarHBondContact O-N 3.25Å; E113-M223 HydrophobicContact CB-SD 4.47Å; E113-M223 HydrophobicContact CG-SD 4.28Å; E113-V226 HydrophobicContact CG-CG1 3.67Å; E113-R230 WeakPolarHBondContact OE1-CD 3.26Å; E113-R230 IonicContact OE1-CZ 3.41Å; E113-R230 IonicContact OE1-NE 3.33Å; E113-R230 IonicContact OE1-NH1 3.13Å; E113-R230 PolarHBondContact OE1-NH1 2.88Å; E113-R230 IonicContact OE2-NH1 3.61Å
114	E	94.3	Very high	94.1	Very high	3 Å²	3	32.5 Å²	32.5	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-65.4	-38	176.2	-69.3	165.4	110.2	0	0	111.6	V110 S111 I116 F117 N222 M223 V226 Q418	V110-E114 HydrophobicContact CG1-CB 3.43Å; V110-E114 VanDerWaalsContact CG1-CB 3.43Å; V110-E114 HydrophobicContact CG1-CG 4.46Å; S111-E114 WeakPolarHBondContact CB-OE2 3.3Å; S111-E114 PolarHBondContact N-OE2 2.9Å; S111-E114 PolarHBondContact O-N 2.98Å; S111-E114 WeakPolarHBondContact OG-CB 3.48Å; S111-E114 VanDerWaalsContact OG-CG 3.25Å; S111-E114 WeakPolarHBondContact OG-CG 3.45Å; S111-E114 PolarHBondContact OG-N 3.32Å; S111-E114 VanDerWaalsContact OG-N 3.09Å; S111-E114 PolarHBondContact OG-OE2 2.98Å; E114-I116 PolarHBondContact O-N 3.33Å; E114-F117 CarbonylContact O-C 3.43Å; E114-F117 PolarHBondContact O-N 2.69Å; E114-N222 WeakPolarHBondContact CG-ND2 3.32Å; E114-N222 PolarHBondContact OE1-ND2 3.26Å; E114-M223 HydrophobicContact CG-CB 4.41Å; E114-M223 HydrophobicContact CG-CE 4.18Å; E114-M223 HydrophobicContact CG-SD 4.03Å; E114-M223 PolarHBondContact OE1-N 3.33Å; E114-V226 HydrophobicContact CG-CG2 4.16Å; E114-Q418 PolarHBondContact OE1-NE2 2.98Å; E114-Q418 VanDerWaalsContact OE1-NE2 3.15Å
115	K	93.7	Very high	94.4	Very high	54 Å²	54	31.6 Å²	31.6	24%	0.235	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-41.7	178.2	-73.6	178.2	-176.1	177.3	0	113.3	V110 S111 E112 E113 F117 T428	V110-K115 HydrophobicContact CB-CG 4.43Å; V110-K115 HydrophobicContact CG1-CG 3.89Å; S111-K115 WeakPolarHBondContact O-CG 3.44Å; S111-K115 PolarHBondContact O-N 2.71Å; E112-K115 PolarHBondContact O-N 2.77Å; E112-K115 WeakPolarHBondContact OE1-CE 3.42Å; E112-K115 IonicContact OE1-NZ 2.81Å; E112-K115 PolarHBondContact OE1-NZ 2.72Å; E112-K115 IonicContact OE2-NZ 3.24Å; E113-K115 VanDerWaalsContact C-N 3.34Å; K115-F117 VanDerWaalsContact C-N 3.26Å; K115-T428 PolarHBondContact NZ-OG1 3.43Å
116	I	95.3	Very high	94.5	Very high	110 Å²	110	35.6 Å²	35.6	56%	0.564	18%	0.18	S	C	*	.	H	α-helix	trans	-83.1	-4.5	-178.8	69	175	0	0	0	113	E112 E113 E114 P118	E112-I116 WeakPolarHBondContact O-CG1 3.3Å; E112-I116 PolarHBondContact O-N 3.29Å; E112-I116 VanDerWaalsContact O-N 3.1Å; E113-I116 WeakPolarHBondContact O-CG1 3.43Å; E113-I116 PolarHBondContact O-N 3.14Å; E114-I116 PolarHBondContact O-N 3.33Å; I116-P118 VanDerWaalsContact C-CD 3.44Å
117	F	97.3	Very high	94.7	Very high	22 Å²	22	37.2 Å²	37.2	10%	0.096	18%	0.184	C	C	.	.	S	Bend	trans	-126.1	65.4	177.5	-156.3	-88.1	0	0	0	112.6	E113 E114 K115 I119 K207 Y208 V226 L229 R230	E113-F117 WeakPolarHBondContact O-CB 3.45Å; E113-F117 PolarHBondContact O-N 3.25Å; E114-F117 CarbonylContact O-C 3.43Å; E114-F117 PolarHBondContact O-N 2.69Å; K115-F117 VanDerWaalsContact C-N 3.26Å; F117-I119 HydrophobicContact CD1-CG1 4.43Å; F117-K207 HydrophobicContact CD1-CB 4.33Å; F117-K207 HydrophobicContact CD1-CG 4.41Å; F117-K207 HydrophobicContact CD2-CB 4.26Å; F117-K207 HydrophobicContact CD2-CG 3.82Å; F117-K207 HydrophobicContact CE1-CB 3.99Å; F117-K207 HydrophobicContact CE1-CG 4.49Å; F117-K207 HydrophobicContact CE2-CB 3.93Å; F117-K207 HydrophobicContact CE2-CG 3.92Å; F117-K207 HydrophobicContact CG-CB 4.47Å; F117-K207 HydrophobicContact CG-CG 4.1Å; F117-K207 HydrophobicContact CZ-CB 3.8Å; F117-K207 HydrophobicContact CZ-CG 4.28Å; F117-Y208 AromaticContact CE1-CD2 3.93Å; F117-Y208 HydrophobicContact CE1-CD2 3.93Å; F117-Y208 HydrophobicContact CE1-CE2 4.48Å; F117-Y208 AromaticContact CZ-CD2 3.63Å; F117-Y208 HydrophobicContact CZ-CD2 3.63Å; F117-Y208 AromaticContact CZ-CE2 3.76Å; F117-Y208 HydrophobicContact CZ-CE2 3.76Å; F117-V226 HydrophobicContact CB-CG1 3.7Å; F117-V226 HydrophobicContact CD1-CB 4.37Å; F117-V226 HydrophobicContact CD1-CG1 3.93Å; F117-V226 HydrophobicContact CD1-CG2 4.16Å; F117-V226 HydrophobicContact CG-CG1 3.95Å; F117-L229 HydrophobicContact CE1-CB 3.6Å; F117-L229 HydrophobicContact CE1-CD1 4.36Å; F117-L229 HydrophobicContact CZ-CB 3.95Å; F117-R230 HydrophobicContact CD1-CG 4.42Å; F117-R230 HydrophobicContact CD2-CG 3.46Å; F117-R230 VanDerWaalsContact CD2-CG 3.46Å; F117-R230 HydrophobicContact CE1-CG 4.37Å; F117-R230 HydrophobicContact CE2-CB 4.32Å; F117-R230 HydrophobicContact CE2-CG 3.39Å; F117-R230 HydrophobicContact CG-CG 3.99Å; F117-R230 HydrophobicContact CZ-CG 3.86Å
118	P	97.8	Very high	95	Very high	18 Å²	18	33 Å²	33	12%	0.117	16%	0.162	C	C	.	.			trans	-62.2	139.2	177.4	-23.7	35.7	0	0	0	112.9	I116 N143 W206 K207	I116-P118 VanDerWaalsContact C-CD 3.44Å; P118-N143 VanDerWaalsContact CB-O 3.25Å; P118-N143 WeakPolarHBondContact CB-O 3.27Å; P118-W206 HydrophobicContact CB-CB 4.22Å; P118-W206 CarbonylContact O-C 3.51Å; P118-W206 VanDerWaalsContact O-CA 3.29Å; P118-W206 WeakPolarHBondContact O-CA 3.48Å; P118-W206 WeakPolarHBondContact O-CB 3.47Å; P118-K207 PolarHBondContact O-N 3.45Å
119	I	98.8	Very high	95.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	138	175.2	-57	170.2	0	0	0	109	F117 Y121 N144 I145 I210 L225 V226 L229	F117-I119 HydrophobicContact CD1-CG1 4.43Å; I119-Y121 HydrophobicContact CB-CE2 3.94Å; I119-Y121 HydrophobicContact CG2-CD2 4.11Å; I119-Y121 HydrophobicContact CG2-CE1 4.4Å; I119-Y121 HydrophobicContact CG2-CE2 3.53Å; I119-N144 PolarHBondContact N-OD1 3.38Å; I119-N144 VanDerWaalsContact O-CA 3.29Å; I119-N144 WeakPolarHBondContact O-CA 3.45Å; I119-N144 WeakPolarHBondContact O-CB 3.43Å; I119-I145 PolarHBondContact O-N 2.91Å; I119-I210 HydrophobicContact CG2-CD1 3.92Å; I119-I210 HydrophobicContact CG2-CG1 3.96Å; I119-L225 HydrophobicContact CD1-CD2 4.1Å; I119-L225 HydrophobicContact CD1-CG 4.14Å; I119-V226 HydrophobicContact CD1-CG2 3.88Å; I119-V226 HydrophobicContact CG1-CG2 4.49Å; I119-L229 HydrophobicContact CD1-CD1 3.73Å; I119-L229 HydrophobicContact CG1-CD1 4.08Å
120	A	98.9	Very high	95.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	147	169.7	0	0	0	0	0	111.2	I145 L199 W206 Y208 V209 I210	A120-I145 CarbonylContact C-O 3.6Å; A120-I145 VanDerWaalsContact CA-O 3.31Å; A120-I145 WeakPolarHBondContact CA-O 3.44Å; A120-I145 HydrophobicContact CB-CG2 3.72Å; A120-L199 HydrophobicContact CB-CD1 4.16Å; A120-L199 HydrophobicContact CB-CD2 4Å; A120-W206 HydrophobicContact CB-CB 4.03Å; A120-W206 HydrophobicContact CB-CD2 3.56Å; A120-W206 HydrophobicContact CB-CE3 3.91Å; A120-W206 HydrophobicContact CB-CG 3.6Å; A120-Y208 PolarHBondContact N-O 2.9Å; A120-V209 HydrophobicContact CB-CB 4.03Å; A120-V209 HydrophobicContact CB-CG2 3.98Å; A120-V209 CarbonylContact O-C 3.54Å; A120-V209 VanDerWaalsContact O-CA 3.26Å; A120-V209 WeakPolarHBondContact O-CA 3.37Å; A120-I210 PolarHBondContact O-N 3.25Å
121	Y	98.9	Very high	96.1	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.008	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.5	176	-68.8	-90.4	0	0	0	111.6	I119 V139 I145 Y146 C147 I210 L212 L225 F394	I119-Y121 HydrophobicContact CB-CE2 3.94Å; I119-Y121 HydrophobicContact CG2-CD2 4.11Å; I119-Y121 HydrophobicContact CG2-CE1 4.4Å; I119-Y121 HydrophobicContact CG2-CE2 3.53Å; Y121-V139 HydrophobicContact CE1-CB 4.22Å; Y121-V139 HydrophobicContact CE1-CG1 4.38Å; Y121-V139 HydrophobicContact CE1-CG2 4.43Å; Y121-I145 PolarHBondContact N-O 3.22Å; Y121-Y146 AromaticContact CD2-CD1 3.61Å; Y121-Y146 HydrophobicContact CD2-CD1 3.61Å; Y121-Y146 AromaticContact CD2-CE1 3.21Å; Y121-Y146 HydrophobicContact CD2-CE1 3.21Å; Y121-Y146 AromaticContact CD2-CZ 3.95Å; Y121-Y146 AromaticContact CE2-CE1 3.69Å; Y121-Y146 HydrophobicContact CE2-CE1 3.69Å; Y121-Y146 AromaticContact CG-CD1 3.86Å; Y121-Y146 HydrophobicContact CG-CD1 3.86Å; Y121-Y146 AromaticContact CG-CE1 3.83Å; Y121-Y146 HydrophobicContact CG-CE1 3.83Å; Y121-C147 PolarHBondContact O-N 3.14Å; Y121-I210 VanDerWaalsContact CA-O 3.3Å; Y121-I210 WeakPolarHBondContact CA-O 3.43Å; Y121-I210 HydrophobicContact CD1-CB 3.94Å; Y121-I210 HydrophobicContact CD1-CG2 4.49Å; Y121-I210 HydrophobicContact CE1-CB 3.95Å; Y121-I210 HydrophobicContact CE1-CD1 3.96Å; Y121-I210 HydrophobicContact CE1-CG1 4.31Å; Y121-I210 HydrophobicContact CE1-CG2 4.38Å; Y121-L212 HydrophobicContact CD1-CD1 3.6Å; Y121-L212 HydrophobicContact CD1-CG 4.21Å; Y121-L212 HydrophobicContact CE1-CD1 4.02Å; Y121-L225 WeakPolarHBondContact OH-CD2 3.16Å; Y121-F394 AromaticContact CE1-CZ 3.97Å; Y121-F394 HydrophobicContact CE1-CZ 3.97Å
122	S	98.8	Very high	96.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	110.9	167.9	176	0	0	0	0	108.9	D192 C195 I210 N211 L212	S122-D192 PolarHBondContact OG-OD1 3.01Å; S122-C195 VanDerWaalsContact OG-CB 3.3Å; S122-C195 WeakPolarHBondContact OG-CB 3.45Å; S122-I210 PolarHBondContact N-O 3.32Å; S122-N211 CarbonylContact O-C 3.59Å; S122-N211 VanDerWaalsContact O-CA 3.29Å; S122-N211 WeakPolarHBondContact O-CA 3.49Å; S122-L212 PolarHBondContact O-N 3.38Å
123	L	98.9	Very high	96.8	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	104.6	-178.9	-61.4	96.4	0	0	0	110.4	V125 L135 Y146 C147 I148 H149 L212	L123-V125 HydrophobicContact CB-CG1 4.25Å; L123-L135 HydrophobicContact CD2-CD2 4.35Å; L123-Y146 HydrophobicContact CD1-CD1 4.29Å; L123-C147 WeakPolarHBondContact CD1-O 3.36Å; L123-C147 PolarHBondContact N-O 3.2Å; L123-I148 HydrophobicContact CB-CG1 4.46Å; L123-I148 HydrophobicContact CD1-CG1 4.45Å; L123-H149 PolarHBondContact O-N 2.9Å; L123-L212 WeakPolarHBondContact CA-O 3.31Å
124	V	98.8	Very high	97.1	Very high	15 Å²	15	22.6 Å²	22.6	9%	0.091	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	107.4	176	179.7	0	0	0	0	109.9	H149 A191 D192 L212 C213	V124-H149 WeakPolarHBondContact CA-O 3.45Å; V124-H149 HydrophobicContact CG2-CB 4.31Å; V124-A191 HydrophobicContact CG1-CB 3.93Å; V124-A191 HydrophobicContact CG2-CB 3.93Å; V124-D192 WeakPolarHBondContact CG2-OD1 3.3Å; V124-L212 PolarHBondContact N-O 2.92Å; V124-C213 WeakPolarHBondContact O-CA 3.05Å
125	V	98.8	Very high	97.3	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	157.7	-166	-59.2	0	0	0	0	112.3	L123 V132 I148 H149 Y150 D151 F158 M162	L123-V125 HydrophobicContact CB-CG1 4.25Å; V125-V132 HydrophobicContact CB-CG2 3.9Å; V125-V132 HydrophobicContact CG1-CG1 4.05Å; V125-V132 HydrophobicContact CG1-CG2 3.79Å; V125-V132 HydrophobicContact CG2-CG2 4.41Å; V125-I148 HydrophobicContact CG2-CG2 3.81Å; V125-H149 PolarHBondContact N-O 2.72Å; V125-Y150 CarbonylContact O-C 3.56Å; V125-Y150 VanDerWaalsContact O-CA 3.27Å; V125-Y150 WeakPolarHBondContact O-CA 3.09Å; V125-D151 PolarHBondContact O-N 3.02Å; V125-F158 HydrophobicContact CB-CZ 3.96Å; V125-F158 HydrophobicContact CG2-CE1 4.02Å; V125-F158 HydrophobicContact CG2-CZ 3.71Å; V125-M162 HydrophobicContact CG2-SD 4.03Å
126	H	97.6	Very high	97.5	Very high	95 Å²	95	19.9 Å²	19.9	44%	0.44	10%	0.096	S	C	.	.			trans	-150.8	-9.4	-179.1	69.8	-83.1	0	0	0	116.8	D151 S154	H126-D151 HydrophobicContact CB-CB 3.68Å; H126-S154 VanDerWaalsContact C-OG 3.28Å; H126-S154 WeakPolarHBondContact CA-OG 3.39Å; H126-S154 WeakPolarHBondContact O-CB 3.37Å; H126-S154 PolarHBondContact O-OG 3.34Å
127	K	95.6	Very high	97.6	Very high	97 Å²	97	17.2 Å²	17.2	42%	0.422	8%	0.079	S	C	.	.	S	Bend	trans	-162.2	171.1	-179.6	65.1	-179.2	179.2	177	0	111	F158	K127-F158 VanDerWaalsContact C-CD2 3.49Å; K127-F158 VanDerWaalsContact CA-CD2 3.47Å; K127-F158 VanDerWaalsContact CA-CE2 3.45Å; K127-F158 VanDerWaalsContact O-CE2 3.24Å; K127-F158 WeakPolarHBondContact O-CE2 3.41Å
128	N	94.8	Very high	97.6	Very high	27 Å²	27	17.5 Å²	17.5	14%	0.144	9%	0.085	C	C	.	.			trans	57.7	69.7	175.7	-56.6	1.8	0	0	0	111.2	E83 W130 M131 V132	E83-N128 PolarHBondContact OE1-OD1 3.3Å; N128-W130 PolarHBondContact O-N 3.4Å; N128-W130 VanDerWaalsContact O-N 3.17Å; N128-M131 HydrophobicContact CB-CB 4.08Å; N128-M131 WeakPolarHBondContact O-CB 3.01Å; N128-M131 PolarHBondContact O-N 3.24Å; N128-V132 PolarHBondContact O-N 3.3Å
129	A	97.1	Very high	97.6	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.9	-34.4	-171.9	0	0	0	0	0	112.9	D86 L89 V132 E133 F158 A161 M162	D86-A129 HydrophobicContact CB-CB 4.14Å; D86-A129 WeakPolarHBondContact OD1-CB 3.28Å; D86-A129 PolarHBondContact OD1-N 3.46Å; L89-A129 HydrophobicContact CD2-CB 3.85Å; A129-V132 WeakPolarHBondContact O-CB 3.49Å; A129-V132 PolarHBondContact O-N 3.07Å; A129-E133 PolarHBondContact O-N 3.46Å; A129-F158 HydrophobicContact CB-CD2 3.88Å; A129-F158 HydrophobicContact CB-CE2 4.09Å; A129-A161 HydrophobicContact CB-CB 3.6Å; A129-M162 HydrophobicContact CB-CE 3.58Å
130	W	94.8	Very high	97.5	Very high	13 Å²	13	17.9 Å²	17.9	5%	0.049	9%	0.085	C	C	.	.	H	α-helix	trans	-65.8	-36.3	174.7	-78.6	103.2	0	0	0	113.9	S51 F52 D84 K85 R88 L89 F92 N128 V132 E133 R134	S51-W130 VanDerWaalsContact OG-CH2 3.3Å; S51-W130 WeakPolarHBondContact OG-CH2 3.44Å; F52-W130 HydrophobicContact CD2-CZ3 4.33Å; F52-W130 AromaticContact CE2-CE3 3.68Å; F52-W130 HydrophobicContact CE2-CE3 3.68Å; F52-W130 AromaticContact CE2-CZ3 3.82Å; F52-W130 HydrophobicContact CE2-CZ3 3.82Å; F52-W130 HydrophobicContact CZ-CE3 4.43Å; D84-W130 HydrophobicContact CB-CB 4.4Å; D84-W130 HydrophobicContact CB-CD2 4.2Å; D84-W130 HydrophobicContact CB-CG 3.71Å; K85-W130 PolarHBondContact O-NE1 3.38Å; R88-W130 HydrophobicContact CB-CZ2 4.15Å; L89-W130 HydrophobicContact CB-CD2 4.38Å; L89-W130 HydrophobicContact CB-CZ2 4.1Å; L89-W130 HydrophobicContact CD1-CE3 4.37Å; L89-W130 HydrophobicContact CD1-CH2 4.11Å; L89-W130 HydrophobicContact CD1-CZ2 4.22Å; L89-W130 HydrophobicContact CD1-CZ3 4.16Å; F92-W130 AromaticContact CD1-CH2 3.82Å; F92-W130 HydrophobicContact CD1-CH2 3.82Å; F92-W130 HydrophobicContact CE1-CH2 4.32Å; N128-W130 PolarHBondContact O-N 3.4Å; N128-W130 VanDerWaalsContact O-N 3.17Å; W130-V132 VanDerWaalsContact C-N 3.3Å; W130-V132 PolarHBondContact O-N 2.97Å; W130-E133 PolarHBondContact O-N 3.48Å; W130-R134 VanDerWaalsContact O-CG 3.31Å; W130-R134 WeakPolarHBondContact O-CG 3.48Å; W130-R134 PolarHBondContact O-N 2.88Å
131	M	95.6	Very high	97.4	Very high	5 Å²	5	18.1 Å²	18.1	3%	0.025	9%	0.087	C	C	.	.	H	α-helix	trans	-66	-38	174	-177.6	61.8	-161.4	0	0	110.8	N128 R134 L135 G214 F217 F398 L407	N128-M131 HydrophobicContact CB-CB 4.08Å; N128-M131 WeakPolarHBondContact O-CB 3.01Å; N128-M131 PolarHBondContact O-N 3.24Å; M131-R134 PolarHBondContact O-N 2.94Å; M131-L135 WeakPolarHBondContact O-CB 3.49Å; M131-L135 PolarHBondContact O-N 3.39Å; M131-G214 WeakPolarHBondContact CG-O 3.4Å; M131-F217 HydrophobicContact CE-CD2 3.83Å; M131-F217 HydrophobicContact CE-CE2 4.47Å; M131-F398 HydrophobicContact CE-CB 3.86Å; M131-L407 HydrophobicContact CE-CD1 4.44Å; M131-L407 HydrophobicContact CE-CD2 3.88Å; M131-L407 HydrophobicContact SD-CD1 3.76Å; M131-L407 HydrophobicContact SD-CD2 4.19Å
132	V	98.1	Very high	97.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.8	-44.1	174.1	-179.1	0	0	0	0	111.2	V125 N128 A129 W130 L135 L136 F158 M162	V125-V132 HydrophobicContact CB-CG2 3.9Å; V125-V132 HydrophobicContact CG1-CG1 4.05Å; V125-V132 HydrophobicContact CG1-CG2 3.79Å; V125-V132 HydrophobicContact CG2-CG2 4.41Å; N128-V132 PolarHBondContact O-N 3.3Å; A129-V132 WeakPolarHBondContact O-CB 3.49Å; A129-V132 PolarHBondContact O-N 3.07Å; W130-V132 VanDerWaalsContact C-N 3.3Å; W130-V132 PolarHBondContact O-N 2.97Å; V132-L135 PolarHBondContact O-N 2.91Å; V132-L136 VanDerWaalsContact O-CB 3.29Å; V132-L136 WeakPolarHBondContact O-CB 3.19Å; V132-L136 PolarHBondContact O-N 2.04Å; V132-F158 HydrophobicContact CG2-CE2 4.13Å; V132-F158 HydrophobicContact CG2-CZ 4.16Å; V132-M162 HydrophobicContact CB-CE 4.04Å; V132-M162 HydrophobicContact CB-SD 4.2Å; V132-M162 HydrophobicContact CG1-CE 4.12Å; V132-M162 HydrophobicContact CG1-SD 3.73Å; V132-M162 HydrophobicContact CG2-CE 4.47Å; V132-M162 HydrophobicContact CG2-SD 4.43Å
133	E	97.8	Very high	97	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62	-44.1	176	-175.1	-80.8	163.9	0	0	111.7	L89 F99 R103 Y105 A129 W130 L135 L136 R137 L165	L89-E133 HydrophobicContact CD1-CG 4.29Å; L89-E133 HydrophobicContact CD2-CB 4.01Å; F99-E133 HydrophobicContact CE2-CG 4.42Å; F99-E133 HydrophobicContact CZ-CG 4.18Å; R103-E133 IonicContact CZ-OE1 3.95Å; R103-E133 IonicContact CZ-OE2 2.89Å; R103-E133 IonicContact NE-OE1 2.69Å; R103-E133 PolarHBondContact NE-OE1 3.4Å; R103-E133 IonicContact NE-OE2 2.71Å; R103-E133 IonicContact NH2-OE1 3.52Å; R103-E133 PolarHBondContact NH2-OE1 3.32Å; R103-E133 IonicContact NH2-OE2 3.46Å; R103-E133 PolarHBondContact NH2-OE2 3.26Å; Y105-E133 PolarHBondContact OH-OE1 3.15Å; A129-E133 PolarHBondContact O-N 3.46Å; W130-E133 PolarHBondContact O-N 3.48Å; E133-L135 PolarHBondContact O-N 2.85Å; E133-L136 PolarHBondContact O-N 3.4Å; E133-R137 VanDerWaalsContact O-CB 3.3Å; E133-R137 WeakPolarHBondContact O-CB 3.32Å; E133-R137 PolarHBondContact O-N 3.12Å; E133-L165 HydrophobicContact CB-CD1 4.17Å; E133-L165 HydrophobicContact CB-CD2 4.15Å; E133-L165 HydrophobicContact CG-CD2 3.78Å
134	R	96.6	Very high	97	Very high	12 Å²	12	23.1 Å²	23.1	5%	0.045	12%	0.117	C	C	.	.	H	α-helix	trans	-60.4	-46.4	176.3	-70.6	-179.7	89.9	163.6	5.8	112.2	F52 W130 M131 R137 A138 F217 L407 Q408 E411	F52-R134 HydrophobicContact CE1-CG 4.07Å; F52-R134 VanDerWaalsContact CE1-CZ 3.47Å; F52-R134 HydrophobicContact CE2-CG 4.22Å; F52-R134 HydrophobicContact CZ-CG 3.39Å; W130-R134 VanDerWaalsContact O-CG 3.31Å; W130-R134 WeakPolarHBondContact O-CG 3.48Å; W130-R134 PolarHBondContact O-N 2.88Å; M131-R134 PolarHBondContact O-N 2.94Å; R134-R137 PolarHBondContact O-N 3.4Å; R134-A138 WeakPolarHBondContact O-CB 3.4Å; R134-A138 PolarHBondContact O-N 3.4Å; R134-F217 HydrophobicContact CB-CE2 4.2Å; R134-L407 VanDerWaalsContact NH1-CB 3.31Å; R134-L407 VanDerWaalsContact NH2-C 3.26Å; R134-Q408 VanDerWaalsContact NH2-N 3.19Å; R134-E411 IonicContact CZ-OE1 3.93Å; R134-E411 IonicContact CZ-OE2 2.62Å; R134-E411 IonicContact NE-OE1 2.64Å; R134-E411 PolarHBondContact NE-OE1 3.04Å; R134-E411 IonicContact NE-OE2 3.96Å; R134-E411 VanDerWaalsContact NH2-CD 3.31Å; R134-E411 IonicContact NH2-OE1 3.67Å; R134-E411 IonicContact NH2-OE2 2.68Å; R134-E411 PolarHBondContact NH2-OE2 3.31Å
135	L	98.5	Very high	97	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58	-51.8	175.7	172	56.3	0	0	0	109.9	L123 M131 V132 E133 R137 A138 V139 L212 C213 D216	L123-L135 HydrophobicContact CD2-CD2 4.35Å; M131-L135 WeakPolarHBondContact O-CB 3.49Å; M131-L135 PolarHBondContact O-N 3.39Å; V132-L135 PolarHBondContact O-N 2.91Å; E133-L135 PolarHBondContact O-N 2.85Å; L135-R137 PolarHBondContact O-N 3.4Å; L135-A138 PolarHBondContact O-N 3.32Å; L135-V139 HydrophobicContact CD1-CG1 4.32Å; L135-V139 WeakPolarHBondContact O-CG2 3.25Å; L135-V139 PolarHBondContact O-N 3.2Å; L135-V139 VanDerWaalsContact O-N 3.13Å; L135-L212 HydrophobicContact CD1-CD1 4.14Å; L135-L212 HydrophobicContact CD2-CB 4.28Å; L135-L212 HydrophobicContact CD2-CD1 4.36Å; L135-L212 HydrophobicContact CG-CD1 4.41Å; L135-C213 VanDerWaalsContact CD2-O 3.3Å; L135-C213 WeakPolarHBondContact CD2-O 3.5Å; L135-D216 WeakPolarHBondContact CD1-O 3.08Å; L135-D216 HydrophobicContact CD2-CB 4.39Å
136	L	98.4	Very high	97	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-56.6	-50	179.3	-179.3	61.6	0	0	0	110.8	V132 E133 A138 V139 Y140 Y146 L169 V172	V132-L136 VanDerWaalsContact O-CB 3.29Å; V132-L136 WeakPolarHBondContact O-CB 3.19Å; V132-L136 PolarHBondContact O-N 2.04Å; E133-L136 PolarHBondContact O-N 3.4Å; L136-A138 VanDerWaalsContact C-N 3.33Å; L136-A138 PolarHBondContact O-N 2.97Å; L136-V139 CarbonylContact O-C 3.59Å; L136-V139 WeakPolarHBondContact O-CG2 3.47Å; L136-V139 PolarHBondContact O-N 3.44Å; L136-Y140 WeakPolarHBondContact O-CA 3.44Å; L136-Y140 WeakPolarHBondContact O-CB 3.24Å; L136-Y140 PolarHBondContact O-N 2.99Å; L136-Y146 HydrophobicContact CD1-CD1 3.54Å; L136-Y146 HydrophobicContact CD1-CD2 4.39Å; L136-Y146 HydrophobicContact CD1-CE1 4.1Å; L136-Y146 HydrophobicContact CD1-CG 3.74Å; L136-L169 HydrophobicContact CD2-CD1 3.68Å; L136-L169 HydrophobicContact CG-CD1 4.46Å; L136-V172 HydrophobicContact CD1-CG2 4.24Å; L136-V172 HydrophobicContact CD2-CG1 4.21Å; L136-V172 HydrophobicContact CD2-CG2 4.2Å
137	R	97.3	Very high	97	Very high	53 Å²	53	18 Å²	18	20%	0.2	9%	0.092	C	C	.	.	H	α-helix	trans	-56.1	-45.2	176.9	-171.5	179.9	71.5	97.7	-0.2	111.9	R103 Y105 E133 R134 L135 V139 Y140 E411 E415	R103-R137 WeakPolarHBondContact O-CD 3.43Å; Y105-R137 HydrophobicContact CE1-CB 4.31Å; Y105-R137 HydrophobicContact CE1-CG 4.42Å; E133-R137 VanDerWaalsContact O-CB 3.3Å; E133-R137 WeakPolarHBondContact O-CB 3.32Å; E133-R137 PolarHBondContact O-N 3.12Å; R134-R137 PolarHBondContact O-N 3.4Å; L135-R137 PolarHBondContact O-N 3.4Å; R137-V139 VanDerWaalsContact C-N 3.27Å; R137-V139 PolarHBondContact O-N 3.18Å; R137-Y140 PolarHBondContact O-N 2.83Å; R137-E411 IonicContact CZ-OE1 3.01Å; R137-E411 IonicContact NH2-OE1 3.81Å; R137-E411 PolarHBondContact NH2-OE1 2.93Å; R137-E411 IonicContact NH2-OE2 3.91Å; R137-E411 PolarHBondContact NH2-OE2 3.18Å; R137-E415 IonicContact CZ-OE1 2.97Å; R137-E415 IonicContact NH1-OE1 3.38Å; R137-E415 PolarHBondContact NH1-OE1 3.38Å
138	A	97.3	Very high	97.2	Very high	28 Å²	28	13.4 Å²	13.4	23%	0.231	7%	0.072	C	C	.	.	H	α-helix	trans	-65.9	-27.6	-178.9	0	0	0	0	0	113.4	R134 L135 L136 F217 P218	R134-A138 WeakPolarHBondContact O-CB 3.4Å; R134-A138 PolarHBondContact O-N 3.4Å; L135-A138 PolarHBondContact O-N 3.32Å; L136-A138 VanDerWaalsContact C-N 3.33Å; L136-A138 PolarHBondContact O-N 2.97Å; A138-F217 HydrophobicContact CB-CE1 4.05Å; A138-F217 HydrophobicContact CB-CE2 4.21Å; A138-F217 HydrophobicContact CB-CZ 3.66Å; A138-P218 HydrophobicContact CB-CG 3.66Å
139	V	97.9	Very high	97.4	Very high	6 Å²	6	12.1 Å²	12.1	4%	0.036	7%	0.065	C	C	.	.	H	α-helix	trans	-102.8	-1.4	176.4	-57.2	0	0	0	0	113.6	Y121 L135 L136 R137 Y146 L212 P218 F394	Y121-V139 HydrophobicContact CE1-CB 4.22Å; Y121-V139 HydrophobicContact CE1-CG1 4.38Å; Y121-V139 HydrophobicContact CE1-CG2 4.43Å; L135-V139 HydrophobicContact CD1-CG1 4.32Å; L135-V139 WeakPolarHBondContact O-CG2 3.25Å; L135-V139 PolarHBondContact O-N 3.2Å; L135-V139 VanDerWaalsContact O-N 3.13Å; L136-V139 CarbonylContact O-C 3.59Å; L136-V139 WeakPolarHBondContact O-CG2 3.47Å; L136-V139 PolarHBondContact O-N 3.44Å; R137-V139 VanDerWaalsContact C-N 3.27Å; R137-V139 PolarHBondContact O-N 3.18Å; V139-Y146 HydrophobicContact CG2-CD1 4.34Å; V139-Y146 HydrophobicContact CG2-CE1 3.7Å; V139-Y146 PolarHBondContact O-OH 2.95Å; V139-L212 HydrophobicContact CG1-CD1 4.46Å; V139-P218 HydrophobicContact CG1-CB 4.13Å; V139-P218 HydrophobicContact CG1-CG 3.83Å; V139-F394 HydrophobicContact CG1-CE1 3.8Å; V139-F394 HydrophobicContact CG1-CZ 4.36Å
140	Y	97.8	Very high	97.5	Very high	21 Å²	21	13.2 Å²	13.2	8%	0.082	7%	0.069	C	C	.	.			trans	-72.4	132.3	-170	-172.9	-86.4	0	0	0	111.4	Y105 L108 L136 R137 Y146 L169 N171 V172	Y105-Y140 AromaticContact CD1-CD1 3.64Å; Y105-Y140 HydrophobicContact CD1-CD1 3.64Å; Y105-Y140 AromaticContact CD1-CD2 4Å; Y105-Y140 HydrophobicContact CD1-CD2 4Å; Y105-Y140 AromaticContact CD1-CE1 3.88Å; Y105-Y140 HydrophobicContact CD1-CE1 3.88Å; Y105-Y140 HydrophobicContact CD1-CE2 4.22Å; Y105-Y140 AromaticContact CD1-CG 3.66Å; Y105-Y140 HydrophobicContact CD1-CG 3.66Å; Y105-Y140 HydrophobicContact CE1-CD1 4.14Å; Y105-Y140 AromaticContact CE1-CD2 3.83Å; Y105-Y140 HydrophobicContact CE1-CD2 3.83Å; Y105-Y140 HydrophobicContact CE1-CE2 4.38Å; Y105-Y140 AromaticContact CE1-CG 3.66Å; Y105-Y140 HydrophobicContact CE1-CG 3.66Å; L108-Y140 HydrophobicContact CD1-CD1 3.36Å; L108-Y140 HydrophobicContact CD1-CE1 3.9Å; L108-Y140 HydrophobicContact CD1-CG 4.44Å; L136-Y140 WeakPolarHBondContact O-CA 3.44Å; L136-Y140 WeakPolarHBondContact O-CB 3.24Å; L136-Y140 PolarHBondContact O-N 2.99Å; R137-Y140 PolarHBondContact O-N 2.83Å; Y140-Y146 WeakPolarHBondContact CA-OH 3.38Å; Y140-Y146 HydrophobicContact CD2-CD2 4.32Å; Y140-Y146 AromaticContact CD2-CE2 3.89Å; Y140-Y146 HydrophobicContact CD2-CE2 3.89Å; Y140-Y146 HydrophobicContact CE2-CE2 4.3Å; Y140-L169 HydrophobicContact CD2-CD1 4.4Å; Y140-L169 HydrophobicContact CE2-CB 4.14Å; Y140-L169 HydrophobicContact CE2-CD1 4.17Å; Y140-L169 HydrophobicContact CE2-CD2 4.08Å; Y140-L169 HydrophobicContact CE2-CG 4.36Å; Y140-N171 WeakPolarHBondContact CE2-OD1 3.41Å; Y140-N171 VanDerWaalsContact CZ-OD1 3.27Å; Y140-N171 PolarHBondContact OH-OD1 3.45Å; Y140-V172 HydrophobicContact CD2-CG2 4.34Å; Y140-V172 HydrophobicContact CE2-CG2 3.99Å
141	S	95.7	Very high	97.6	Very high	5 Å²	5	13 Å²	13	4%	0.035	7%	0.069	C	C	.	.			trans	-140.7	139.3	166.1	170.5	0	0	0	0	107.7	N143 N144 Y146 N171	S141-N143 PolarHBondContact O-N 3.18Å; S141-N143 VanDerWaalsContact O-N 3.12Å; S141-N143 PolarHBondContact OG-N 3.09Å; S141-N144 WeakPolarHBondContact CB-ND2 3.21Å; S141-N144 PolarHBondContact O-N 2.67Å; S141-N144 VanDerWaalsContact O-N 3.12Å; S141-Y146 PolarHBondContact N-OH 3.02Å; S141-N171 PolarHBondContact O-ND2 3.31Å
142	P	95.1	Very high	97.8	Very high	61 Å²	61	18.8 Å²	18.8	40%	0.396	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.7	177.6	27.1	-35.9	0	0	0	113.1	V110	V110-P142 HydrophobicContact CG2-CG 3.62Å
143	N	94.9	Very high	97.7	Very high	46 Å²	46	22.2 Å²	22.2	25%	0.246	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-15.4	178.5	-69.1	92.4	0	0	0	113.6	P118 S141	P118-N143 VanDerWaalsContact CB-O 3.25Å; P118-N143 WeakPolarHBondContact CB-O 3.27Å; S141-N143 PolarHBondContact O-N 3.18Å; S141-N143 VanDerWaalsContact O-N 3.12Å; S141-N143 PolarHBondContact OG-N 3.09Å
144	N	97.9	Very high	97.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-85.6	178.4	177.6	-72.6	-11.6	0	0	0	111.1	I119 S141 Y146 N171 N222	I119-N144 PolarHBondContact N-OD1 3.38Å; I119-N144 VanDerWaalsContact O-CA 3.29Å; I119-N144 WeakPolarHBondContact O-CA 3.45Å; I119-N144 WeakPolarHBondContact O-CB 3.43Å; S141-N144 WeakPolarHBondContact CB-ND2 3.21Å; S141-N144 PolarHBondContact O-N 2.67Å; S141-N144 VanDerWaalsContact O-N 3.12Å; N144-Y146 HydrophobicContact CB-CE2 3.69Å; N144-Y146 WeakPolarHBondContact CB-OH 3.28Å; N144-Y146 PolarHBondContact ND2-OH 3.02Å; N144-N171 WeakPolarHBondContact O-CB 3.5Å; N144-N171 PolarHBondContact O-ND2 2.98Å; N144-N222 PolarHBondContact ND2-OD1 2.91Å
145	I	98.8	Very high	97.7	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.026	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	141.6	174.8	-172.3	175.5	0	0	0	111.3	I119 A120 Y121 F173 L199 S202 F204 W206	I119-I145 PolarHBondContact O-N 2.91Å; A120-I145 CarbonylContact C-O 3.6Å; A120-I145 VanDerWaalsContact CA-O 3.31Å; A120-I145 WeakPolarHBondContact CA-O 3.44Å; A120-I145 HydrophobicContact CB-CG2 3.72Å; Y121-I145 PolarHBondContact N-O 3.22Å; I145-F173 HydrophobicContact CD1-CD1 4.3Å; I145-F173 HydrophobicContact CD1-CE1 3.68Å; I145-F173 HydrophobicContact CG1-CD1 4.24Å; I145-F173 HydrophobicContact CG1-CE1 3.78Å; I145-L199 HydrophobicContact CB-CD2 4.43Å; I145-L199 HydrophobicContact CD1-CD2 4.13Å; I145-L199 HydrophobicContact CG1-CD2 4.02Å; I145-L199 HydrophobicContact CG2-CD2 3.75Å; I145-S202 WeakPolarHBondContact CD1-OG 3.27Å; I145-F204 HydrophobicContact CB-CB 4.2Å; I145-F204 HydrophobicContact CB-CD1 4.12Å; I145-F204 HydrophobicContact CB-CD2 4.42Å; I145-F204 HydrophobicContact CB-CG 4Å; I145-F204 HydrophobicContact CD1-CB 4.09Å; I145-F204 HydrophobicContact CD1-CD2 3.71Å; I145-F204 HydrophobicContact CD1-CE2 4.37Å; I145-F204 HydrophobicContact CD1-CG 3.99Å; I145-F204 HydrophobicContact CG1-CD2 4.36Å; I145-F204 HydrophobicContact CG1-CG 4.42Å; I145-F204 HydrophobicContact CG2-CB 4.11Å; I145-F204 HydrophobicContact CG2-CG 4.46Å; I145-W206 HydrophobicContact CG2-CB 4.48Å; I145-W206 HydrophobicContact CG2-CG 4.3Å
146	Y	98.9	Very high	97.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	119.2	-171.2	-52.2	-94.2	0	0	0	110.8	Y121 L123 L136 V139 Y140 S141 N144 N171 V172 F173	Y121-Y146 AromaticContact CD2-CD1 3.61Å; Y121-Y146 HydrophobicContact CD2-CD1 3.61Å; Y121-Y146 AromaticContact CD2-CE1 3.21Å; Y121-Y146 HydrophobicContact CD2-CE1 3.21Å; Y121-Y146 AromaticContact CD2-CZ 3.95Å; Y121-Y146 AromaticContact CE2-CE1 3.69Å; Y121-Y146 HydrophobicContact CE2-CE1 3.69Å; Y121-Y146 AromaticContact CG-CD1 3.86Å; Y121-Y146 HydrophobicContact CG-CD1 3.86Å; Y121-Y146 AromaticContact CG-CE1 3.83Å; Y121-Y146 HydrophobicContact CG-CE1 3.83Å; L123-Y146 HydrophobicContact CD1-CD1 4.29Å; L136-Y146 HydrophobicContact CD1-CD1 3.54Å; L136-Y146 HydrophobicContact CD1-CD2 4.39Å; L136-Y146 HydrophobicContact CD1-CE1 4.1Å; L136-Y146 HydrophobicContact CD1-CG 3.74Å; V139-Y146 HydrophobicContact CG2-CD1 4.34Å; V139-Y146 HydrophobicContact CG2-CE1 3.7Å; V139-Y146 PolarHBondContact O-OH 2.95Å; Y140-Y146 WeakPolarHBondContact CA-OH 3.38Å; Y140-Y146 HydrophobicContact CD2-CD2 4.32Å; Y140-Y146 AromaticContact CD2-CE2 3.89Å; Y140-Y146 HydrophobicContact CD2-CE2 3.89Å; Y140-Y146 HydrophobicContact CE2-CE2 4.3Å; S141-Y146 PolarHBondContact N-OH 3.02Å; N144-Y146 HydrophobicContact CB-CE2 3.69Å; N144-Y146 WeakPolarHBondContact CB-OH 3.28Å; N144-Y146 PolarHBondContact ND2-OH 3.02Å; Y146-N171 PolarHBondContact N-O 2.75Å; Y146-V172 HydrophobicContact CD2-CG2 3.88Å; Y146-V172 HydrophobicContact CG-CG2 4.17Å; Y146-V172 WeakPolarHBondContact O-CA 3.45Å; Y146-F173 WeakPolarHBondContact O-CD1 3.34Å; Y146-F173 PolarHBondContact O-N 2.8Å
147	C	98.9	Very high	97.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.3	169.4	179.8	0	0	0	0	110	Y121 L123 F173 C195 L199	Y121-C147 PolarHBondContact O-N 3.14Å; L123-C147 WeakPolarHBondContact CD1-O 3.36Å; L123-C147 PolarHBondContact N-O 3.2Å; C147-F173 WeakPolarHBondContact CA-O 3.17Å; C147-F173 HydrophobicContact CB-CE1 4.08Å; C147-F173 HydrophobicContact CB-CE2 3.78Å; C147-F173 HydrophobicContact CB-CZ 3.53Å; C147-C195 VanDerWaalsContact C-SG 3.6Å; C147-C195 HydrophobicContact CB-CB 3.67Å; C147-C195 WeakPolarHBondContact CB-SG 3.29Å; C147-C195 WeakPolarHBondContact SG-CA 3.47Å; C147-C195 WeakPolarHBondContact SG-CB 3.46Å; C147-C195 CovalentContact SG-SG 2.04Å; C147-C195 PolarHBondContact SG-SG 3.44Å; C147-L199 HydrophobicContact CB-CD1 4.07Å; C147-L199 HydrophobicContact CB-CD2 4.1Å; C147-L199 HydrophobicContact CB-CG 3.92Å
148	I	98.9	Very high	97.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.8	172.8	-60.8	175.8	0	0	0	108.7	L123 V125 M162 V172 F173 I174 S175	L123-I148 HydrophobicContact CB-CG1 4.46Å; L123-I148 HydrophobicContact CD1-CG1 4.45Å; V125-I148 HydrophobicContact CG2-CG2 3.81Å; I148-M162 HydrophobicContact CG2-CG 4.48Å; I148-M162 HydrophobicContact CG2-SD 4.21Å; I148-V172 HydrophobicContact CD1-CG1 3.58Å; I148-V172 HydrophobicContact CG1-CG1 4.08Å; I148-F173 PolarHBondContact N-O 2.83Å; I148-I174 HydrophobicContact CB-CD1 3.82Å; I148-I174 HydrophobicContact CD1-CD1 4.46Å; I148-I174 HydrophobicContact CG2-CD1 3.98Å; I148-I174 WeakPolarHBondContact O-CA 3.41Å; I148-S175 PolarHBondContact O-N 2.8Å
149	H	98.9	Very high	97.8	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	97.4	165.5	-179.6	-62.8	0	0	0	108.9	L123 V124 V125 K177 L178 E179 A191	L123-H149 PolarHBondContact O-N 2.9Å; V124-H149 WeakPolarHBondContact CA-O 3.45Å; V124-H149 HydrophobicContact CG2-CB 4.31Å; V125-H149 PolarHBondContact N-O 2.72Å; H149-K177 PolarHBondContact CD2-O 3.34Å; H149-L178 WeakPolarHBondContact NE2-CA 3.15Å; H149-E179 PolarHBondContact CE1-N 3.09Å; H149-E179 VanDerWaalsContact CE1-N 3.29Å; H149-E179 PolarHBondContact NE2-N 3.21Å; H149-A191 PolarHBondContact CD2-O 2.96Å; H149-A191 VanDerWaalsContact CE1-CB 3.47Å; H149-A191 WeakPolarHBondContact CE1-CB 3.39Å
150	Y	98.8	Very high	97.8	Very high	22 Å²	22	31.4 Å²	31.4	9%	0.086	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	147.6	168.4	62.7	-102.2	0	0	0	111.7	V125 V159 M162 K163 I174 L178	V125-Y150 CarbonylContact O-C 3.56Å; V125-Y150 VanDerWaalsContact O-CA 3.27Å; V125-Y150 WeakPolarHBondContact O-CA 3.09Å; Y150-V159 HydrophobicContact CD2-CG1 4.49Å; Y150-V159 HydrophobicContact CD2-CG2 3.8Å; Y150-V159 HydrophobicContact CE1-CG1 4.4Å; Y150-V159 HydrophobicContact CE2-CB 4.33Å; Y150-V159 HydrophobicContact CE2-CG1 3.77Å; Y150-V159 HydrophobicContact CE2-CG2 3.74Å; Y150-M162 HydrophobicContact CD1-CB 3.97Å; Y150-M162 HydrophobicContact CD1-CG 4.38Å; Y150-K163 WeakPolarHBondContact OH-CE 3.36Å; Y150-I174 HydrophobicContact CD1-CD1 4.11Å; Y150-I174 HydrophobicContact CD1-CG2 4Å; Y150-I174 HydrophobicContact CE1-CB 4.45Å; Y150-I174 HydrophobicContact CE1-CD1 4.09Å; Y150-I174 HydrophobicContact CE1-CG1 4.17Å; Y150-I174 HydrophobicContact CE1-CG2 3.43Å; Y150-I174 VanDerWaalsContact CE1-CG2 3.43Å; Y150-L178 HydrophobicContact CD2-CD1 4.1Å; Y150-L178 HydrophobicContact CE1-CD1 3.98Å; Y150-L178 HydrophobicContact CE2-CD1 3.41Å; Y150-L178 VanDerWaalsContact CE2-CD1 3.41Å; Y150-L178 WeakPolarHBondContact OH-CD1 3.2Å
151	D	98.4	Very high	97.9	Very high	9 Å²	9	30.4 Å²	30.4	5%	0.048	18%	0.175	C	C	.	.			trans	-69.7	132.6	176.8	-163.8	-28.2	0	0	0	111.8	V125 H126 K153 S154 T180 V181	V125-D151 PolarHBondContact O-N 3.02Å; H126-D151 HydrophobicContact CB-CB 3.68Å; D151-K153 VanDerWaalsContact CG-NZ 3.31Å; D151-K153 PolarHBondContact O-N 2.85Å; D151-K153 VanDerWaalsContact O-N 3.08Å; D151-K153 WeakPolarHBondContact OD1-CG 3.3Å; D151-K153 PolarHBondContact OD1-N 2.84Å; D151-K153 IonicContact OD1-NZ 3.74Å; D151-K153 PolarHBondContact OD1-NZ 3.11Å; D151-K153 WeakPolarHBondContact OD2-CE 3.41Å; D151-K153 IonicContact OD2-NZ 3.46Å; D151-K153 PolarHBondContact OD2-NZ 3.16Å; D151-S154 VanDerWaalsContact O-CB 3.26Å; D151-S154 WeakPolarHBondContact O-CB 3.38Å; D151-S154 PolarHBondContact O-N 3.22Å; D151-S154 PolarHBondContact O-OG 2.62Å; D151-T180 WeakPolarHBondContact OD1-CA 3.46Å; D151-V181 PolarHBondContact OD1-N 3.17Å; D151-V181 WeakPolarHBondContact OD2-CB 3.49Å; D151-V181 PolarHBondContact OD2-N 2.9Å
152	K	97.9	Very high	98	Very high	127 Å²	127	30.2 Å²	30.2	55%	0.552	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.3	178	-85	177.9	165.1	160.7	0	114.3	L178 E179 T180	K152-L178 HydrophobicContact CD-CB 4.37Å; K152-L178 WeakPolarHBondContact CD-O 3.45Å; K152-L178 WeakPolarHBondContact CE-O 3.12Å; K152-L178 HydrophobicContact CG-CB 3.93Å; K152-L178 PolarHBondContact NZ-O 3.25Å; K152-E179 PolarHBondContact N-O 2.68Å; K152-E179 VanDerWaalsContact N-O 3.13Å; K152-T180 WeakPolarHBondContact CB-OG1 3.29Å
153	K	95.9	Very high	98.2	Very high	71 Å²	71	32.6 Å²	32.6	31%	0.309	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	7.9	176.8	61.6	165.5	-179.5	-59.8	0	114.5	D151 T180 V181 K265	D151-K153 VanDerWaalsContact CG-NZ 3.31Å; D151-K153 PolarHBondContact O-N 2.85Å; D151-K153 VanDerWaalsContact O-N 3.08Å; D151-K153 WeakPolarHBondContact OD1-CG 3.3Å; D151-K153 PolarHBondContact OD1-N 2.84Å; D151-K153 IonicContact OD1-NZ 3.74Å; D151-K153 PolarHBondContact OD1-NZ 3.11Å; D151-K153 WeakPolarHBondContact OD2-CE 3.41Å; D151-K153 IonicContact OD2-NZ 3.46Å; D151-K153 PolarHBondContact OD2-NZ 3.16Å; K153-T180 HydrophobicContact CB-CG2 4.33Å; K153-T180 HydrophobicContact CD-CG2 4.3Å; K153-T180 HydrophobicContact CG-CG2 4.17Å; K153-V181 PolarHBondContact NZ-O 3.48Å; K153-K265 HydrophobicContact CD-CD 4.06Å
154	S	97.4	Very high	98.3	Very high	21 Å²	21	30.9 Å²	30.9	15%	0.147	17%	0.171	C	C	.	.	S	Bend	trans	-63.7	160.5	171.5	-70.9	0	0	0	0	112.1	H126 D151	H126-S154 VanDerWaalsContact C-OG 3.28Å; H126-S154 WeakPolarHBondContact CA-OG 3.39Å; H126-S154 WeakPolarHBondContact O-CB 3.37Å; H126-S154 PolarHBondContact O-OG 3.34Å; D151-S154 VanDerWaalsContact O-CB 3.26Å; D151-S154 WeakPolarHBondContact O-CB 3.38Å; D151-S154 PolarHBondContact O-N 3.22Å; D151-S154 PolarHBondContact O-OG 2.62Å
155	S	97.6	Very high	98.4	Very high	56 Å²	56	30.9 Å²	30.9	39%	0.392	17%	0.171	S	C	.	.			trans	-62.2	152.9	175.6	63.7	0	0	0	0	111.2	Q157 F158 V159	S155-Q157 PolarHBondContact O-N 2.72Å; S155-F158 PolarHBondContact O-N 3.2Å; S155-F158 VanDerWaalsContact OG-CB 3.25Å; S155-F158 WeakPolarHBondContact OG-CB 3.45Å; S155-F158 PolarHBondContact OG-N 3.47Å; S155-V159 WeakPolarHBondContact O-CG2 3.41Å; S155-V159 PolarHBondContact O-N 3.23Å
156	A	98.3	Very high	98.3	Very high	75 Å²	75	31.9 Å²	31.9	62%	0.62	18%	0.179	S	C	*	.	H	α-helix	trans	-59.1	-36.6	177.5	0	0	0	0	0	111.8	V159 A160	A156-V159 PolarHBondContact O-N 3.28Å; A156-A160 WeakPolarHBondContact O-CB 3.45Å; A156-A160 PolarHBondContact O-N 3.06Å
157	Q	98.3	Very high	98.3	Very high	79 Å²	79	36 Å²	36	37%	0.369	21%	0.208	S	C	.	.	H	α-helix	trans	-63.9	-47.3	177	-64.3	79	2.2	0	0	111.5	D86 E87 I90 S155 V159 A160 A161	D86-Q157 HydrophobicContact CB-CB 4Å; E87-Q157 HydrophobicContact CG-CB 4.48Å; E87-Q157 HydrophobicContact CG-CG 3.9Å; E87-Q157 WeakPolarHBondContact OE1-CG 3.45Å; I90-Q157 HydrophobicContact CD1-CB 4.38Å; S155-Q157 PolarHBondContact O-N 2.72Å; Q157-V159 VanDerWaalsContact C-N 3.34Å; Q157-V159 PolarHBondContact O-N 3.12Å; Q157-A160 PolarHBondContact O-N 3.16Å; Q157-A161 WeakPolarHBondContact O-CB 3.4Å; Q157-A161 PolarHBondContact O-N 2.9Å
158	F	98.5	Very high	98.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-45.9	176	-178.2	-98	0	0	0	111.3	D86 V125 K127 A129 V132 S155 A160 A161 M162	D86-F158 WeakPolarHBondContact OD2-CA 3.26Å; D86-F158 WeakPolarHBondContact OD2-CB 3.46Å; V125-F158 HydrophobicContact CB-CZ 3.96Å; V125-F158 HydrophobicContact CG2-CE1 4.02Å; V125-F158 HydrophobicContact CG2-CZ 3.71Å; K127-F158 VanDerWaalsContact C-CD2 3.49Å; K127-F158 VanDerWaalsContact CA-CD2 3.47Å; K127-F158 VanDerWaalsContact CA-CE2 3.45Å; K127-F158 VanDerWaalsContact O-CE2 3.24Å; K127-F158 WeakPolarHBondContact O-CE2 3.41Å; A129-F158 HydrophobicContact CB-CD2 3.88Å; A129-F158 HydrophobicContact CB-CE2 4.09Å; V132-F158 HydrophobicContact CG2-CE2 4.13Å; V132-F158 HydrophobicContact CG2-CZ 4.16Å; S155-F158 PolarHBondContact O-N 3.2Å; S155-F158 VanDerWaalsContact OG-CB 3.25Å; S155-F158 WeakPolarHBondContact OG-CB 3.45Å; S155-F158 PolarHBondContact OG-N 3.47Å; F158-A160 PolarHBondContact O-N 3.42Å; F158-A161 PolarHBondContact O-N 3.22Å; F158-M162 HydrophobicContact CD1-CG 4.1Å; F158-M162 HydrophobicContact CD2-CE 4.49Å; F158-M162 HydrophobicContact CE1-CG 3.64Å; F158-M162 HydrophobicContact CE1-SD 4.26Å; F158-M162 HydrophobicContact CE2-CE 3.93Å; F158-M162 HydrophobicContact CE2-CG 4.35Å; F158-M162 HydrophobicContact CE2-SD 4.21Å; F158-M162 HydrophobicContact CZ-CE 4.12Å; F158-M162 HydrophobicContact CZ-CG 3.77Å; F158-M162 HydrophobicContact CZ-SD 3.77Å; F158-M162 WeakPolarHBondContact O-CG 3.37Å; F158-M162 PolarHBondContact O-N 2.93Å
159	V	98.7	Very high	98.2	Very high	26 Å²	26	36.1 Å²	36.1	16%	0.158	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-44.9	178.2	171.1	0	0	0	0	111.4	Y150 S155 A156 Q157 A161 M162 K163	Y150-V159 HydrophobicContact CD2-CG1 4.49Å; Y150-V159 HydrophobicContact CD2-CG2 3.8Å; Y150-V159 HydrophobicContact CE1-CG1 4.4Å; Y150-V159 HydrophobicContact CE2-CB 4.33Å; Y150-V159 HydrophobicContact CE2-CG1 3.77Å; Y150-V159 HydrophobicContact CE2-CG2 3.74Å; S155-V159 WeakPolarHBondContact O-CG2 3.41Å; S155-V159 PolarHBondContact O-N 3.23Å; A156-V159 PolarHBondContact O-N 3.28Å; Q157-V159 VanDerWaalsContact C-N 3.34Å; Q157-V159 PolarHBondContact O-N 3.12Å; V159-A161 VanDerWaalsContact C-N 3.34Å; V159-M162 PolarHBondContact O-N 3.32Å; V159-K163 HydrophobicContact CG1-CD 4.39Å; V159-K163 WeakPolarHBondContact O-CG 3.5Å; V159-K163 PolarHBondContact O-N 2.78Å; V159-K163 VanDerWaalsContact O-N 3.07Å
160	A	98.7	Very high	98.1	Very high	36 Å²	36	41.6 Å²	41.6	30%	0.298	24%	0.244	S	C	.	.	H	α-helix	trans	-62.6	-41.4	177	0	0	0	0	0	111.7	I90 A156 Q157 F158 K163 G164	I90-A160 HydrophobicContact CD1-CB 3.63Å; I90-A160 HydrophobicContact CG1-CB 4.05Å; A156-A160 WeakPolarHBondContact O-CB 3.45Å; A156-A160 PolarHBondContact O-N 3.06Å; Q157-A160 PolarHBondContact O-N 3.16Å; F158-A160 PolarHBondContact O-N 3.42Å; A160-K163 PolarHBondContact O-N 3.26Å; A160-G164 PolarHBondContact O-N 3.08Å
161	A	98.6	Very high	98	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-42.5	177	0	0	0	0	0	112.3	L89 I90 A129 Q157 F158 V159 K163 G164 L165	L89-A161 HydrophobicContact CB-CB 4.3Å; L89-A161 HydrophobicContact CD2-CB 4.23Å; L89-A161 HydrophobicContact CG-CB 4.39Å; I90-A161 HydrophobicContact CG1-CB 3.97Å; A129-A161 HydrophobicContact CB-CB 3.6Å; Q157-A161 WeakPolarHBondContact O-CB 3.4Å; Q157-A161 PolarHBondContact O-N 2.9Å; F158-A161 PolarHBondContact O-N 3.22Å; V159-A161 VanDerWaalsContact C-N 3.34Å; A161-K163 VanDerWaalsContact C-N 3.34Å; A161-K163 PolarHBondContact O-N 3.46Å; A161-G164 PolarHBondContact O-N 3.47Å; A161-L165 WeakPolarHBondContact O-CG 3.35Å; A161-L165 PolarHBondContact O-N 3.22Å
162	M	98.8	Very high	98	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-40.1	175.6	-65.8	-57	96.1	0	0	112.1	V125 A129 V132 I148 Y150 F158 V159 L165 S166 I174	V125-M162 HydrophobicContact CG2-SD 4.03Å; A129-M162 HydrophobicContact CB-CE 3.58Å; V132-M162 HydrophobicContact CB-CE 4.04Å; V132-M162 HydrophobicContact CB-SD 4.2Å; V132-M162 HydrophobicContact CG1-CE 4.12Å; V132-M162 HydrophobicContact CG1-SD 3.73Å; V132-M162 HydrophobicContact CG2-CE 4.47Å; V132-M162 HydrophobicContact CG2-SD 4.43Å; I148-M162 HydrophobicContact CG2-CG 4.48Å; I148-M162 HydrophobicContact CG2-SD 4.21Å; Y150-M162 HydrophobicContact CD1-CB 3.97Å; Y150-M162 HydrophobicContact CD1-CG 4.38Å; F158-M162 HydrophobicContact CD1-CG 4.1Å; F158-M162 HydrophobicContact CD2-CE 4.49Å; F158-M162 HydrophobicContact CE1-CG 3.64Å; F158-M162 HydrophobicContact CE1-SD 4.26Å; F158-M162 HydrophobicContact CE2-CE 3.93Å; F158-M162 HydrophobicContact CE2-CG 4.35Å; F158-M162 HydrophobicContact CE2-SD 4.21Å; F158-M162 HydrophobicContact CZ-CE 4.12Å; F158-M162 HydrophobicContact CZ-CG 3.77Å; F158-M162 HydrophobicContact CZ-SD 3.77Å; F158-M162 WeakPolarHBondContact O-CG 3.37Å; F158-M162 PolarHBondContact O-N 2.93Å; V159-M162 PolarHBondContact O-N 3.32Å; M162-L165 HydrophobicContact CE-CD1 3.66Å; M162-L165 PolarHBondContact O-N 3.49Å; M162-L165 HydrophobicContact SD-CD1 4.31Å; M162-S166 PolarHBondContact O-N 2.89Å; M162-S166 VanDerWaalsContact O-N 3.08Å; M162-S166 PolarHBondContact O-OG 3.33Å; M162-I174 HydrophobicContact CB-CD1 4.28Å
163	K	98.7	Very high	98	Very high	111 Å²	111	37.4 Å²	37.4	48%	0.483	23%	0.227	S	C	.	.	H	α-helix	trans	-63.5	-44.2	174.3	-72.7	178.3	178.2	-177.1	0	111.5	Y150 V159 A160 A161 L165 S166 S167	Y150-K163 WeakPolarHBondContact OH-CE 3.36Å; V159-K163 HydrophobicContact CG1-CD 4.39Å; V159-K163 WeakPolarHBondContact O-CG 3.5Å; V159-K163 PolarHBondContact O-N 2.78Å; V159-K163 VanDerWaalsContact O-N 3.07Å; A160-K163 PolarHBondContact O-N 3.26Å; A161-K163 VanDerWaalsContact C-N 3.34Å; A161-K163 PolarHBondContact O-N 3.46Å; K163-L165 PolarHBondContact O-N 3.26Å; K163-S166 PolarHBondContact O-N 3.07Å; K163-S166 PolarHBondContact O-OG 3.07Å; K163-S167 PolarHBondContact O-N 3.31Å; K163-S167 PolarHBondContact O-OG 3.03Å
164	G	98.4	Very high	98.2	Very high	10 Å²	10	35.8 Å²	35.8	10%	0.103	22%	0.221	C	C	.	.	H	α-helix	trans	-54.6	-50.6	174.4	0	0	0	0	0	112.2	T93 A160 A161 S166 S167 C168	T93-G164 WeakPolarHBondContact OG1-CA 3.3Å; A160-G164 PolarHBondContact O-N 3.08Å; A161-G164 PolarHBondContact O-N 3.47Å; G164-S166 PolarHBondContact O-N 2.91Å; G164-S167 PolarHBondContact O-N 2.73Å; G164-S167 VanDerWaalsContact O-N 3.16Å; G164-S167 PolarHBondContact O-OG 2.95Å; G164-C168 PolarHBondContact O-N 2.86Å; G164-C168 VanDerWaalsContact O-N 3.12Å
165	L	98.3	Very high	98.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-54.7	-51.4	175.1	-71.4	178.5	0	0	0	112.4	L89 T93 F99 E133 A161 M162 K163 S167 C168 L169	L89-L165 HydrophobicContact CD1-CD2 4.13Å; L89-L165 HydrophobicContact CD2-CD1 4.07Å; L89-L165 HydrophobicContact CD2-CD2 4.12Å; L89-L165 HydrophobicContact CD2-CG 4.09Å; L89-L165 HydrophobicContact CG-CD2 4.41Å; T93-L165 HydrophobicContact CG2-CD2 4.12Å; F99-L165 HydrophobicContact CE1-CD2 4.24Å; F99-L165 HydrophobicContact CE2-CD2 4.28Å; F99-L165 HydrophobicContact CZ-CD2 3.56Å; E133-L165 HydrophobicContact CB-CD1 4.17Å; E133-L165 HydrophobicContact CB-CD2 4.15Å; E133-L165 HydrophobicContact CG-CD2 3.78Å; A161-L165 WeakPolarHBondContact O-CG 3.35Å; A161-L165 PolarHBondContact O-N 3.22Å; M162-L165 HydrophobicContact CE-CD1 3.66Å; M162-L165 PolarHBondContact O-N 3.49Å; M162-L165 HydrophobicContact SD-CD1 4.31Å; K163-L165 PolarHBondContact O-N 3.26Å; L165-S167 VanDerWaalsContact C-N 3.26Å; L165-S167 PolarHBondContact O-N 3.46Å; L165-C168 PolarHBondContact O-N 3.16Å; L165-L169 PolarHBondContact O-N 3.09Å
166	S	98.4	Very high	98.3	Very high	27 Å²	27	37.1 Å²	37.1	19%	0.189	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-30.9	-179.9	67.4	0	0	0	0	113.2	M162 K163 G164	M162-S166 PolarHBondContact O-N 2.89Å; M162-S166 VanDerWaalsContact O-N 3.08Å; M162-S166 PolarHBondContact O-OG 3.33Å; K163-S166 PolarHBondContact O-N 3.07Å; K163-S166 PolarHBondContact O-OG 3.07Å; G164-S166 PolarHBondContact O-N 2.91Å
167	S	98.3	Very high	98.3	Very high	87 Å²	87	39 Å²	39	61%	0.608	22%	0.224	S	C	*	.	H	α-helix	trans	-74.8	-27.8	177.6	69.9	0	0	0	0	113.3	K163 G164 L165	K163-S167 PolarHBondContact O-N 3.31Å; K163-S167 PolarHBondContact O-OG 3.03Å; G164-S167 PolarHBondContact O-N 2.73Å; G164-S167 VanDerWaalsContact O-N 3.16Å; G164-S167 PolarHBondContact O-OG 2.95Å; L165-S167 VanDerWaalsContact C-N 3.26Å; L165-S167 PolarHBondContact O-N 3.46Å
168	C	98.4	Very high	98.3	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-86.6	-22.6	-178.5	-68.4	0	0	0	0	114.1	T93 C96 F99 R100 G164 L165	T93-C168 PolarHBondContact O-SG 3.25Å; C96-C168 WeakPolarHBondContact CA-SG 3.4Å; C96-C168 HydrophobicContact CB-CB 3.61Å; C96-C168 WeakPolarHBondContact CB-SG 3.47Å; C96-C168 WeakPolarHBondContact SG-CA 3.26Å; C96-C168 WeakPolarHBondContact SG-CB 3.47Å; C96-C168 CovalentContact SG-SG 2.05Å; C96-C168 PolarHBondContact SG-SG 3.44Å; F99-C168 HydrophobicContact CD1-CB 3.88Å; F99-C168 HydrophobicContact CE1-CB 4.21Å; R100-C168 WeakPolarHBondContact CD-O 3.5Å; R100-C168 PolarHBondContact NH1-O 3.14Å; G164-C168 PolarHBondContact O-N 2.86Å; G164-C168 VanDerWaalsContact O-N 3.12Å; L165-C168 PolarHBondContact O-N 3.16Å
169	L	97.8	Very high	98.3	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	22%	0.22	C	C	.	.	S	Bend	trans	-115.6	116.2	-173	-60.8	173.2	0	0	0	110.2	R100 Y105 L136 Y140 L165 N171 V172	R100-L169 HydrophobicContact CG-CD2 4.13Å; Y105-L169 HydrophobicContact CD1-CD1 4.35Å; Y105-L169 HydrophobicContact CD1-CD2 3.65Å; Y105-L169 HydrophobicContact CD2-CD2 3.91Å; Y105-L169 HydrophobicContact CE1-CD1 3.84Å; Y105-L169 HydrophobicContact CE1-CD2 4Å; Y105-L169 HydrophobicContact CE2-CD1 4.35Å; Y105-L169 HydrophobicContact CE2-CD2 4.25Å; Y105-L169 HydrophobicContact CG-CD2 3.6Å; L136-L169 HydrophobicContact CD2-CD1 3.68Å; L136-L169 HydrophobicContact CG-CD1 4.46Å; Y140-L169 HydrophobicContact CD2-CD1 4.4Å; Y140-L169 HydrophobicContact CE2-CB 4.14Å; Y140-L169 HydrophobicContact CE2-CD1 4.17Å; Y140-L169 HydrophobicContact CE2-CD2 4.08Å; Y140-L169 HydrophobicContact CE2-CG 4.36Å; L165-L169 PolarHBondContact O-N 3.09Å; L169-N171 VanDerWaalsContact C-N 3.29Å; L169-N171 PolarHBondContact O-N 3.25Å; L169-V172 HydrophobicContact CB-CB 3.87Å; L169-V172 HydrophobicContact CB-CG2 3.49Å; L169-V172 VanDerWaalsContact CB-CG2 3.49Å; L169-V172 HydrophobicContact CD1-CG2 3.87Å; L169-V172 HydrophobicContact CG-CG2 4.33Å; L169-V172 PolarHBondContact O-N 2.8Å; L169-V172 VanDerWaalsContact O-N 3.16Å
170	P	95.3	Very high	98.3	Very high	115 Å²	115	39 Å²	39	75%	0.747	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.9	-164.9	27.1	-36.1	0	0	0	115
171	N	97.3	Very high	98.3	Very high	7 Å²	7	38.4 Å²	38.4	4%	0.037	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	17.4	-179.9	61.4	-24.6	0	0	0	112.6	Y140 S141 N144 Y146 L169 F204	Y140-N171 WeakPolarHBondContact CE2-OD1 3.41Å; Y140-N171 VanDerWaalsContact CZ-OD1 3.27Å; Y140-N171 PolarHBondContact OH-OD1 3.45Å; S141-N171 PolarHBondContact O-ND2 3.31Å; N144-N171 WeakPolarHBondContact O-CB 3.5Å; N144-N171 PolarHBondContact O-ND2 2.98Å; Y146-N171 PolarHBondContact N-O 2.75Å; L169-N171 VanDerWaalsContact C-N 3.29Å; L169-N171 PolarHBondContact O-N 3.25Å; N171-F204 HydrophobicContact CB-CE1 4.27Å; N171-F204 HydrophobicContact CB-CZ 3.88Å
172	V	98.7	Very high	98.2	Very high	7 Å²	7	40.1 Å²	40.1	4%	0.042	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.5	175.3	-176.5	0	0	0	0	108.4	L136 Y140 Y146 I148 L169	L136-V172 HydrophobicContact CD1-CG2 4.24Å; L136-V172 HydrophobicContact CD2-CG1 4.21Å; L136-V172 HydrophobicContact CD2-CG2 4.2Å; Y140-V172 HydrophobicContact CD2-CG2 4.34Å; Y140-V172 HydrophobicContact CE2-CG2 3.99Å; Y146-V172 HydrophobicContact CD2-CG2 3.88Å; Y146-V172 HydrophobicContact CG-CG2 4.17Å; Y146-V172 WeakPolarHBondContact O-CA 3.45Å; I148-V172 HydrophobicContact CD1-CG1 3.58Å; I148-V172 HydrophobicContact CG1-CG1 4.08Å; L169-V172 HydrophobicContact CB-CB 3.87Å; L169-V172 HydrophobicContact CB-CG2 3.49Å; L169-V172 VanDerWaalsContact CB-CG2 3.49Å; L169-V172 HydrophobicContact CD1-CG2 3.87Å; L169-V172 HydrophobicContact CG-CG2 4.33Å; L169-V172 PolarHBondContact O-N 2.8Å; L169-V172 VanDerWaalsContact O-N 3.16Å
173	F	98.8	Very high	98.1	Very high	56 Å²	56	45.2 Å²	45.2	25%	0.246	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	157	-179.8	68.1	-87.6	0	0	0	111.7	I145 Y146 C147 I148 D198 L199	I145-F173 HydrophobicContact CD1-CD1 4.3Å; I145-F173 HydrophobicContact CD1-CE1 3.68Å; I145-F173 HydrophobicContact CG1-CD1 4.24Å; I145-F173 HydrophobicContact CG1-CE1 3.78Å; Y146-F173 WeakPolarHBondContact O-CD1 3.34Å; Y146-F173 PolarHBondContact O-N 2.8Å; C147-F173 WeakPolarHBondContact CA-O 3.17Å; C147-F173 HydrophobicContact CB-CE1 4.08Å; C147-F173 HydrophobicContact CB-CE2 3.78Å; C147-F173 HydrophobicContact CB-CZ 3.53Å; I148-F173 PolarHBondContact N-O 2.83Å; F173-D198 HydrophobicContact CE2-CB 3.49Å; F173-D198 VanDerWaalsContact CE2-CB 3.49Å; F173-D198 HydrophobicContact CZ-CB 3.85Å; F173-L199 HydrophobicContact CE1-CD2 3.9Å; F173-L199 HydrophobicContact CZ-CD2 3.9Å; F173-L199 HydrophobicContact CZ-CG 4.13Å
174	I	98.9	Very high	98	Very high	37 Å²	37	40.2 Å²	40.2	19%	0.19	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	135.6	172	-56.5	-51.9	0	0	0	108.6	I148 Y150 M162 S176 L178	I148-I174 HydrophobicContact CB-CD1 3.82Å; I148-I174 HydrophobicContact CD1-CD1 4.46Å; I148-I174 HydrophobicContact CG2-CD1 3.98Å; I148-I174 WeakPolarHBondContact O-CA 3.41Å; Y150-I174 HydrophobicContact CD1-CD1 4.11Å; Y150-I174 HydrophobicContact CD1-CG2 4Å; Y150-I174 HydrophobicContact CE1-CB 4.45Å; Y150-I174 HydrophobicContact CE1-CD1 4.09Å; Y150-I174 HydrophobicContact CE1-CG1 4.17Å; Y150-I174 HydrophobicContact CE1-CG2 3.43Å; Y150-I174 VanDerWaalsContact CE1-CG2 3.43Å; M162-I174 HydrophobicContact CB-CD1 4.28Å; I174-S176 PolarHBondContact O-N 2.92Å; I174-L178 HydrophobicContact CG2-CD1 4.27Å; I174-L178 HydrophobicContact CG2-CD2 4.09Å
175	S	98.7	Very high	98	Very high	6 Å²	6	40 Å²	40	4%	0.042	22%	0.223	C	C	.	.			trans	-53.5	138.5	176.3	-174.6	0	0	0	0	111.7	I148 K177 D198	I148-S175 PolarHBondContact O-N 2.8Å; S175-K177 PolarHBondContact O-N 3.29Å; S175-K177 PolarHBondContact OG-N 3.48Å; S175-K177 PolarHBondContact OG-O 2.93Å; S175-D198 WeakPolarHBondContact CA-OD2 3.41Å; S175-D198 WeakPolarHBondContact CB-OD2 3.34Å; S175-D198 PolarHBondContact OG-OD2 2.93Å
176	S	98.4	Very high	98	Very high	99 Å²	99	41.1 Å²	41.1	69%	0.692	23%	0.229	S	C	*	.	S	Bend	trans	-61.5	-26.8	178.3	69.3	0	0	0	0	112.2	I174 D198	I174-S176 PolarHBondContact O-N 2.92Å; S176-D198 VanDerWaalsContact CB-OD1 3.31Å; S176-D198 WeakPolarHBondContact CB-OD1 3.49Å; S176-D198 PolarHBondContact N-OD2 3.5Å; S176-D198 PolarHBondContact OG-OD1 3.35Å; S176-D198 PolarHBondContact OG-OD2 3.2Å
177	K	98.6	Very high	98	Very high	113 Å²	113	40.2 Å²	40.2	49%	0.491	22%	0.223	S	C	.	.	S	Bend	trans	-127.4	118.6	178.5	-172	179.7	172.9	-164.9	0	111.5	H149 S175 E179 N194	H149-K177 PolarHBondContact CD2-O 3.34Å; S175-K177 PolarHBondContact O-N 3.29Å; S175-K177 PolarHBondContact OG-N 3.48Å; S175-K177 PolarHBondContact OG-O 2.93Å; K177-E179 VanDerWaalsContact CE-OE1 3.26Å; K177-E179 WeakPolarHBondContact CE-OE1 3.46Å; K177-E179 IonicContact NZ-OE1 3.36Å; K177-N194 HydrophobicContact CB-CB 4.24Å; K177-N194 VanDerWaalsContact O-CB 3.32Å; K177-N194 WeakPolarHBondContact O-CB 3.48Å; K177-N194 PolarHBondContact O-ND2 3.01Å
178	L	98.8	Very high	98	Very high	23 Å²	23	37.6 Å²	37.6	12%	0.12	20%	0.2	C	C	.	.			trans	-105.7	140.4	179.4	-58.2	168	0	0	0	111.6	H149 Y150 K152 I174	H149-L178 WeakPolarHBondContact NE2-CA 3.15Å; Y150-L178 HydrophobicContact CD2-CD1 4.1Å; Y150-L178 HydrophobicContact CE1-CD1 3.98Å; Y150-L178 HydrophobicContact CE2-CD1 3.41Å; Y150-L178 VanDerWaalsContact CE2-CD1 3.41Å; Y150-L178 WeakPolarHBondContact OH-CD1 3.2Å; K152-L178 HydrophobicContact CD-CB 4.37Å; K152-L178 WeakPolarHBondContact CD-O 3.45Å; K152-L178 WeakPolarHBondContact CE-O 3.12Å; K152-L178 HydrophobicContact CG-CB 3.93Å; K152-L178 PolarHBondContact NZ-O 3.25Å; I174-L178 HydrophobicContact CG2-CD1 4.27Å; I174-L178 HydrophobicContact CG2-CD2 4.09Å
179	E	98.6	Very high	98	Very high	33 Å²	33	37.6 Å²	37.6	15%	0.154	20%	0.199	C	C	.	.			trans	-105.3	152.8	177.8	-58.9	-59.5	156.6	0	0	111.8	H149 K152 K177 V181 K190 N194	H149-E179 PolarHBondContact CE1-N 3.09Å; H149-E179 VanDerWaalsContact CE1-N 3.29Å; H149-E179 PolarHBondContact NE2-N 3.21Å; K152-E179 PolarHBondContact N-O 2.68Å; K152-E179 VanDerWaalsContact N-O 3.13Å; K177-E179 VanDerWaalsContact CE-OE1 3.26Å; K177-E179 WeakPolarHBondContact CE-OE1 3.46Å; K177-E179 IonicContact NZ-OE1 3.36Å; E179-V181 HydrophobicContact CB-CG2 4.18Å; E179-K190 HydrophobicContact CG-CB 3.85Å; E179-N194 WeakPolarHBondContact CG-ND2 3.34Å; E179-N194 PolarHBondContact OE1-ND2 2.64Å
180	T	98.1	Very high	98.1	Very high	51 Å²	51	40 Å²	40	31%	0.313	21%	0.21	S	C	.	.			trans	-88	107.1	161.7	-57.8	0	0	0	0	107.9	D151 K152 K153 F182 S187	D151-T180 WeakPolarHBondContact OD1-CA 3.46Å; K152-T180 WeakPolarHBondContact CB-OG1 3.29Å; K153-T180 HydrophobicContact CB-CG2 4.33Å; K153-T180 HydrophobicContact CD-CG2 4.3Å; K153-T180 HydrophobicContact CG-CG2 4.17Å; T180-F182 HydrophobicContact CG2-CE1 4.16Å; T180-F182 HydrophobicContact CG2-CE2 3.86Å; T180-F182 HydrophobicContact CG2-CZ 3.57Å; T180-F182 WeakPolarHBondContact O-CD2 3.39Å; T180-F182 PolarHBondContact O-N 3.24Å; T180-S187 WeakPolarHBondContact O-CB 3.1Å
181	V	97.7	Very high	98.2	Very high	23 Å²	23	34.6 Å²	34.6	14%	0.139	17%	0.174	C	C	.	.			trans	-89.3	101.2	-165	-177.9	0	0	0	0	113.5	D151 K153 E179 S187 R188 A191	D151-V181 PolarHBondContact OD1-N 3.17Å; D151-V181 WeakPolarHBondContact OD2-CB 3.49Å; D151-V181 PolarHBondContact OD2-N 2.9Å; K153-V181 PolarHBondContact NZ-O 3.48Å; E179-V181 HydrophobicContact CB-CG2 4.18Å; V181-S187 VanDerWaalsContact CA-OG 3.3Å; V181-S187 WeakPolarHBondContact CA-OG 3.3Å; V181-R188 HydrophobicContact CG1-CB 3.9Å; V181-A191 HydrophobicContact CG2-CB 4.09Å
182	F	97.5	Very high	98.3	Very high	36 Å²	36	34.2 Å²	34.2	16%	0.158	17%	0.173	C	C	.	.			trans	-85.9	137.9	173.4	-56.6	-74.3	0	0	0	111.9	T180 S185 S187 L257 K265 K266	T180-F182 HydrophobicContact CG2-CE1 4.16Å; T180-F182 HydrophobicContact CG2-CE2 3.86Å; T180-F182 HydrophobicContact CG2-CZ 3.57Å; T180-F182 WeakPolarHBondContact O-CD2 3.39Å; T180-F182 PolarHBondContact O-N 3.24Å; F182-S185 PolarHBondContact O-N 2.93Å; F182-S185 VanDerWaalsContact O-N 3.14Å; F182-S185 PolarHBondContact O-OG 2.98Å; F182-S185 VanDerWaalsContact O-OG 3.13Å; F182-S187 PolarHBondContact N-OG 3.27Å; F182-S187 PolarHBondContact O-OG 3.1Å; F182-L257 HydrophobicContact CB-CD2 4.12Å; F182-L257 HydrophobicContact CD2-CD1 3.85Å; F182-L257 HydrophobicContact CE2-CD1 4.43Å; F182-L257 HydrophobicContact CG-CD1 4.42Å; F182-K265 HydrophobicContact CE1-CB 4.39Å; F182-K266 HydrophobicContact CD1-CB 3.67Å; F182-K266 HydrophobicContact CD1-CG 4.17Å; F182-K266 HydrophobicContact CE1-CB 3.93Å; F182-K266 HydrophobicContact CE1-CD 4.12Å; F182-K266 HydrophobicContact CE1-CG 3.88Å; F182-K266 HydrophobicContact CG-CB 4.16Å; F182-K266 HydrophobicContact CZ-CD 4.09Å; F182-K266 HydrophobicContact CZ-CG 4.37Å
183	Y	96.7	Very high	98.3	Very high	107 Å²	107	35.4 Å²	35.4	42%	0.42	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	137.8	179.9	176.9	-99.5	0	0	0	111.2	S185 Y264 L267 P268	Y183-S185 PolarHBondContact O-N 2.79Å; Y183-Y264 HydrophobicContact CD1-CD1 4.12Å; Y183-Y264 AromaticContact CD1-CE1 3.9Å; Y183-Y264 HydrophobicContact CD1-CE1 3.9Å; Y183-Y264 HydrophobicContact CD2-CE1 4.28Å; Y183-Y264 HydrophobicContact CE1-CE1 4.43Å; Y183-Y264 AromaticContact CG-CD1 3.97Å; Y183-Y264 HydrophobicContact CG-CD1 3.97Å; Y183-Y264 AromaticContact CG-CE1 3.79Å; Y183-Y264 HydrophobicContact CG-CE1 3.79Å; Y183-L267 HydrophobicContact CD1-CD2 3.62Å; Y183-L267 HydrophobicContact CG-CD2 4.34Å; Y183-P268 VanDerWaalsContact O-CD 3.24Å; Y183-P268 WeakPolarHBondContact O-CD 3.28Å
184	A	97.1	Very high	98.3	Very high	6 Å²	6	33.7 Å²	33.7	5%	0.05	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	9.1	-177.5	0	0	0	0	0	115.7	P268 Y318 S319	A184-P268 HydrophobicContact CB-CG 4.19Å; A184-P268 WeakPolarHBondContact O-CG 3.45Å; A184-Y318 HydrophobicContact CB-CD1 4.26Å; A184-Y318 HydrophobicContact CB-CD2 4.28Å; A184-Y318 HydrophobicContact CB-CE1 3.76Å; A184-Y318 HydrophobicContact CB-CE2 3.78Å; A184-Y318 HydrophobicContact CB-CG 4.49Å; A184-Y318 VanDerWaalsContact CB-CZ 3.49Å; A184-S319 VanDerWaalsContact CB-OG 3.3Å; A184-S319 WeakPolarHBondContact CB-OG 3.33Å; A184-S319 WeakPolarHBondContact O-CA 3.21Å; A184-S319 PolarHBondContact O-N 2.72Å
185	S	97.8	Very high	98.3	Very high	6 Å²	6	31.9 Å²	31.9	4%	0.042	16%	0.163	C	C	.	.	S	Bend	trans	-101.4	163.1	178.5	95.7	0	0	0	0	112.3	F182 Y183 S187 R188	F182-S185 PolarHBondContact O-N 2.93Å; F182-S185 VanDerWaalsContact O-N 3.14Å; F182-S185 PolarHBondContact O-OG 2.98Å; F182-S185 VanDerWaalsContact O-OG 3.13Å; Y183-S185 PolarHBondContact O-N 2.79Å; S185-S187 PolarHBondContact O-N 3.14Å; S185-S187 PolarHBondContact OG-N 2.86Å; S185-S187 PolarHBondContact OG-OG 3.31Å; S185-R188 PolarHBondContact O-N 2.81Å
186	I	98.4	Very high	98.3	Very high	22 Å²	22	31.8 Å²	31.8	11%	0.113	16%	0.162	C	C	.	.	H	α-helix	trans	-52.5	-24.8	176.3	-167.3	67.8	0	0	0	114.2	R188 L189 K190 L311 E315 P320	I186-R188 PolarHBondContact O-N 3.25Å; I186-R188 VanDerWaalsContact O-N 3.15Å; I186-L189 HydrophobicContact CD1-CB 4.14Å; I186-L189 HydrophobicContact CD1-CD2 3.72Å; I186-L189 HydrophobicContact CD1-CG 4.32Å; I186-L189 WeakPolarHBondContact O-CB 3.43Å; I186-L189 PolarHBondContact O-N 2.96Å; I186-K190 HydrophobicContact CG1-CD 4.25Å; I186-K190 HydrophobicContact CG1-CG 4.21Å; I186-K190 HydrophobicContact CG2-CD 4.49Å; I186-K190 PolarHBondContact O-N 3.03Å; I186-L311 HydrophobicContact CD1-CD1 4.26Å; I186-E315 WeakPolarHBondContact CB-O 3.49Å; I186-E315 HydrophobicContact CG1-CB 4.42Å; I186-E315 HydrophobicContact CG1-CG 4.3Å; I186-E315 WeakPolarHBondContact CG2-O 3.47Å; I186-P320 HydrophobicContact CB-CG 4.04Å; I186-P320 HydrophobicContact CD1-CB 3.83Å; I186-P320 HydrophobicContact CD1-CG 3.56Å; I186-P320 HydrophobicContact CG1-CG 4.4Å
187	S	98.4	Very high	98.3	Very high	9 Å²	9	29.6 Å²	29.6	6%	0.063	15%	0.146	C	C	.	.	H	α-helix	trans	-57.9	-30.3	177.7	62.6	0	0	0	0	112.8	T180 V181 F182 S185 A191	T180-S187 WeakPolarHBondContact O-CB 3.1Å; V181-S187 VanDerWaalsContact CA-OG 3.3Å; V181-S187 WeakPolarHBondContact CA-OG 3.3Å; F182-S187 PolarHBondContact N-OG 3.27Å; F182-S187 PolarHBondContact O-OG 3.1Å; S185-S187 PolarHBondContact O-N 3.14Å; S185-S187 PolarHBondContact OG-N 2.86Å; S185-S187 PolarHBondContact OG-OG 3.31Å; S187-A191 PolarHBondContact O-N 2.76Å
188	R	98.4	Very high	98.3	Very high	32 Å²	32	25.1 Å²	25.1	12%	0.121	13%	0.128	C	C	.	.	H	α-helix	trans	-67.3	-43.8	176.3	175.7	60.6	-167.6	84.2	1.5	110.7	V181 S185 I186 A191 D192 D321	V181-R188 HydrophobicContact CG1-CB 3.9Å; S185-R188 PolarHBondContact O-N 2.81Å; I186-R188 PolarHBondContact O-N 3.25Å; I186-R188 VanDerWaalsContact O-N 3.15Å; R188-A191 PolarHBondContact O-N 3.49Å; R188-D192 IonicContact CZ-OD2 3.4Å; R188-D192 VanDerWaalsContact NH1-CG 3.35Å; R188-D192 IonicContact NH1-OD1 2.88Å; R188-D192 IonicContact NH1-OD2 2.74Å; R188-D192 PolarHBondContact NH1-OD2 3.16Å; R188-D192 IonicContact NH2-OD2 3.22Å; R188-D192 PolarHBondContact NH2-OD2 3.09Å; R188-D192 VanDerWaalsContact NH2-OD2 3.09Å; R188-D321 HydrophobicContact CG-CB 4.29Å
189	L	98.6	Very high	98.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-44.4	175	175.9	57.4	0	0	0	111.2	I186 A191 D192 L193 L311 P320 D321 F324 W325	I186-L189 HydrophobicContact CD1-CB 4.14Å; I186-L189 HydrophobicContact CD1-CD2 3.72Å; I186-L189 HydrophobicContact CD1-CG 4.32Å; I186-L189 WeakPolarHBondContact O-CB 3.43Å; I186-L189 PolarHBondContact O-N 2.96Å; L189-A191 VanDerWaalsContact C-N 3.28Å; L189-A191 PolarHBondContact O-N 2.86Å; L189-D192 PolarHBondContact O-N 3.3Å; L189-L193 HydrophobicContact CD1-CD1 4.26Å; L189-L193 HydrophobicContact CD1-CG 4.25Å; L189-L193 HydrophobicContact CG-CD1 3.87Å; L189-L193 HydrophobicContact CG-CG 4.35Å; L189-L193 WeakPolarHBondContact O-CG 3.46Å; L189-L193 PolarHBondContact O-N 3.41Å; L189-L311 HydrophobicContact CD2-CD1 3.82Å; L189-L311 HydrophobicContact CG-CD1 4.49Å; L189-P320 HydrophobicContact CD2-CB 4.13Å; L189-D321 HydrophobicContact CB-CB 4.48Å; L189-F324 HydrophobicContact CD1-CB 4.5Å; L189-F324 HydrophobicContact CD1-CD1 3.72Å; L189-F324 HydrophobicContact CD1-CE1 4.24Å; L189-F324 HydrophobicContact CD1-CG 4.32Å; L189-F324 HydrophobicContact CD2-CB 3.68Å; L189-F324 HydrophobicContact CD2-CD1 3.69Å; L189-F324 HydrophobicContact CD2-CD2 3.98Å; L189-F324 HydrophobicContact CD2-CE1 4.24Å; L189-F324 HydrophobicContact CD2-CG 3.51Å; L189-F324 HydrophobicContact CG-CD1 4.33Å; L189-W325 HydrophobicContact CD1-CD2 4.34Å; L189-W325 HydrophobicContact CD1-CH2 3.94Å; L189-W325 HydrophobicContact CD1-CZ2 3.14Å
190	K	98.7	Very high	98.2	Very high	53 Å²	53	23.8 Å²	23.8	23%	0.23	12%	0.121	C	C	.	.	H	α-helix	trans	-59.2	-36.1	177.8	-74.8	178.4	175.7	179.3	0	112.9	E179 I186 D192 L193 N194 E315	E179-K190 HydrophobicContact CG-CB 3.85Å; I186-K190 HydrophobicContact CG1-CD 4.25Å; I186-K190 HydrophobicContact CG1-CG 4.21Å; I186-K190 HydrophobicContact CG2-CD 4.49Å; I186-K190 PolarHBondContact O-N 3.03Å; K190-D192 PolarHBondContact O-N 2.92Å; K190-L193 PolarHBondContact O-N 2.71Å; K190-N194 WeakPolarHBondContact O-CB 3.37Å; K190-N194 PolarHBondContact O-N 3.04Å; K190-N194 PolarHBondContact O-ND2 3.22Å; K190-N194 PolarHBondContact O-OD1 3.01Å; K190-E315 WeakPolarHBondContact CE-OE1 3.28Å; K190-E315 IonicContact NZ-OE1 3.74Å; K190-E315 PolarHBondContact NZ-OE1 3.18Å
191	A	98.8	Very high	98	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.8	-44.2	176	0	0	0	0	0	112.8	V124 H149 V181 S187 R188 L189 C195	V124-A191 HydrophobicContact CG1-CB 3.93Å; V124-A191 HydrophobicContact CG2-CB 3.93Å; H149-A191 PolarHBondContact CD2-O 2.96Å; H149-A191 VanDerWaalsContact CE1-CB 3.47Å; H149-A191 WeakPolarHBondContact CE1-CB 3.39Å; V181-A191 HydrophobicContact CG2-CB 4.09Å; S187-A191 PolarHBondContact O-N 2.76Å; R188-A191 PolarHBondContact O-N 3.49Å; L189-A191 VanDerWaalsContact C-N 3.28Å; L189-A191 PolarHBondContact O-N 2.86Å; A191-C195 PolarHBondContact O-N 3.29Å
192	D	98.7	Very high	97.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.2	-45.9	173.9	-87.1	-40.7	0	0	0	111.1	S122 V124 R188 L189 K190 N194 C195 L196 N211 F291 W325	S122-D192 PolarHBondContact OG-OD1 3.01Å; V124-D192 WeakPolarHBondContact CG2-OD1 3.3Å; R188-D192 IonicContact CZ-OD2 3.4Å; R188-D192 VanDerWaalsContact NH1-CG 3.35Å; R188-D192 IonicContact NH1-OD1 2.88Å; R188-D192 IonicContact NH1-OD2 2.74Å; R188-D192 PolarHBondContact NH1-OD2 3.16Å; R188-D192 IonicContact NH2-OD2 3.22Å; R188-D192 PolarHBondContact NH2-OD2 3.09Å; R188-D192 VanDerWaalsContact NH2-OD2 3.09Å; L189-D192 PolarHBondContact O-N 3.3Å; K190-D192 PolarHBondContact O-N 2.92Å; D192-N194 VanDerWaalsContact C-N 3.27Å; D192-N194 PolarHBondContact O-N 3.33Å; D192-C195 PolarHBondContact O-N 3.18Å; D192-C195 VanDerWaalsContact O-N 3.12Å; D192-L196 WeakPolarHBondContact O-CB 2.98Å; D192-L196 WeakPolarHBondContact O-CG 3.25Å; D192-L196 PolarHBondContact O-N 2.82Å; D192-N211 WeakPolarHBondContact OD1-CB 3.31Å; D192-N211 PolarHBondContact OD2-ND2 2.84Å; D192-F291 HydrophobicContact CB-CZ 4.43Å; D192-W325 HydrophobicContact CB-CZ2 4.17Å
193	L	98.8	Very high	97.4	Very high	31 Å²	31	34 Å²	34	16%	0.162	18%	0.175	C	C	.	.	H	α-helix	trans	-57.1	-38.7	179.7	-69.3	169.8	0	0	0	112.9	L189 K190 L196 S197 M301 L311 F324 W325	L189-L193 HydrophobicContact CD1-CD1 4.26Å; L189-L193 HydrophobicContact CD1-CG 4.25Å; L189-L193 HydrophobicContact CG-CD1 3.87Å; L189-L193 HydrophobicContact CG-CG 4.35Å; L189-L193 WeakPolarHBondContact O-CG 3.46Å; L189-L193 PolarHBondContact O-N 3.41Å; K190-L193 PolarHBondContact O-N 2.71Å; L193-L196 PolarHBondContact O-N 3.36Å; L193-S197 WeakPolarHBondContact O-CB 3.14Å; L193-S197 PolarHBondContact O-N 2.81Å; L193-M301 HydrophobicContact CD2-CE 3.81Å; L193-L311 HydrophobicContact CD1-CD1 3.7Å; L193-L311 HydrophobicContact CD1-CD2 3.68Å; L193-L311 HydrophobicContact CD1-CG 4.37Å; L193-F324 HydrophobicContact CD2-CE1 4.42Å; L193-W325 HydrophobicContact CD2-CH2 3.74Å; L193-W325 HydrophobicContact CD2-CZ3 4.48Å; L193-W325 HydrophobicContact CG-CH2 4.34Å
194	N	98.8	Very high	97.1	Very high	20 Å²	20	32.3 Å²	32.3	11%	0.107	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-46.5	176.7	-67.1	-17.6	0	0	0	111	K177 E179 K190 D192 L196 S197 D198	K177-N194 HydrophobicContact CB-CB 4.24Å; K177-N194 VanDerWaalsContact O-CB 3.32Å; K177-N194 WeakPolarHBondContact O-CB 3.48Å; K177-N194 PolarHBondContact O-ND2 3.01Å; E179-N194 WeakPolarHBondContact CG-ND2 3.34Å; E179-N194 PolarHBondContact OE1-ND2 2.64Å; K190-N194 WeakPolarHBondContact O-CB 3.37Å; K190-N194 PolarHBondContact O-N 3.04Å; K190-N194 PolarHBondContact O-ND2 3.22Å; K190-N194 PolarHBondContact O-OD1 3.01Å; D192-N194 VanDerWaalsContact C-N 3.27Å; D192-N194 PolarHBondContact O-N 3.33Å; N194-L196 PolarHBondContact O-N 3.27Å; N194-S197 WeakPolarHBondContact O-CB 3.46Å; N194-S197 PolarHBondContact O-N 3.07Å; N194-D198 PolarHBondContact O-N 2.82Å; N194-D198 VanDerWaalsContact O-N 3.14Å
195	C	98.8	Very high	97	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-42.5	174.6	-95.7	0	0	0	0	112.7	S122 C147 A191 D192 S197 D198 L199	S122-C195 VanDerWaalsContact OG-CB 3.3Å; S122-C195 WeakPolarHBondContact OG-CB 3.45Å; C147-C195 VanDerWaalsContact C-SG 3.6Å; C147-C195 HydrophobicContact CB-CB 3.67Å; C147-C195 WeakPolarHBondContact CB-SG 3.29Å; C147-C195 WeakPolarHBondContact SG-CA 3.47Å; C147-C195 WeakPolarHBondContact SG-CB 3.46Å; C147-C195 CovalentContact SG-SG 2.04Å; C147-C195 PolarHBondContact SG-SG 3.44Å; A191-C195 PolarHBondContact O-N 3.29Å; D192-C195 PolarHBondContact O-N 3.18Å; D192-C195 VanDerWaalsContact O-N 3.12Å; C195-S197 VanDerWaalsContact C-N 3.29Å; C195-S197 PolarHBondContact O-N 2.85Å; C195-D198 PolarHBondContact O-N 3.31Å; C195-L199 WeakPolarHBondContact O-CB 3.45Å; C195-L199 WeakPolarHBondContact O-CD1 3.35Å; C195-L199 WeakPolarHBondContact O-CG 3.41Å; C195-L199 PolarHBondContact O-N 3.18Å
196	L	98.7	Very high	97	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-38.6	177.9	-68.3	173.4	0	0	0	112.1	D192 L193 N194 L200 V209 F291 I298 W325	D192-L196 WeakPolarHBondContact O-CB 2.98Å; D192-L196 WeakPolarHBondContact O-CG 3.25Å; D192-L196 PolarHBondContact O-N 2.82Å; L193-L196 PolarHBondContact O-N 3.36Å; N194-L196 PolarHBondContact O-N 3.27Å; L196-L200 PolarHBondContact O-N 2.05Å; L196-L200 VanDerWaalsContact O-N 3.07Å; L196-V209 HydrophobicContact CD2-CB 4.13Å; L196-V209 HydrophobicContact CD2-CG1 3.61Å; L196-V209 HydrophobicContact CD2-CG2 3.58Å; L196-F291 HydrophobicContact CD1-CZ 4.01Å; L196-F291 HydrophobicContact CD2-CE2 4.38Å; L196-F291 HydrophobicContact CD2-CZ 4.46Å; L196-I298 HydrophobicContact CB-CG2 4.1Å; L196-I298 HydrophobicContact CD1-CD1 4.05Å; L196-I298 HydrophobicContact CD2-CD1 3.99Å; L196-I298 HydrophobicContact CD2-CG1 4.42Å; L196-W325 HydrophobicContact CD1-CH2 3.6Å; L196-W325 HydrophobicContact CD1-CZ2 4.4Å; L196-W325 HydrophobicContact CD1-CZ3 4.24Å
197	S	98.1	Very high	97	Very high	52 Å²	52	42.3 Å²	42.3	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-62.2	-50.2	174.9	-168.5	0	0	0	0	111.2	L193 N194 C195 L199 L200 T201	L193-S197 WeakPolarHBondContact O-CB 3.14Å; L193-S197 PolarHBondContact O-N 2.81Å; N194-S197 WeakPolarHBondContact O-CB 3.46Å; N194-S197 PolarHBondContact O-N 3.07Å; C195-S197 VanDerWaalsContact C-N 3.29Å; C195-S197 PolarHBondContact O-N 2.85Å; S197-L199 PolarHBondContact O-N 2.9Å; S197-L200 WeakPolarHBondContact O-CB 3.5Å; S197-L200 PolarHBondContact O-N 3.38Å; S197-T201 PolarHBondContact O-N 2.74Å
198	D	98.4	Very high	97	Very high	20 Å²	20	42.2 Å²	42.2	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-43.2	178.9	-63.2	-34.6	0	0	0	111.8	F173 S175 S176 N194 C195 L200 T201 S202	F173-D198 HydrophobicContact CE2-CB 3.49Å; F173-D198 VanDerWaalsContact CE2-CB 3.49Å; F173-D198 HydrophobicContact CZ-CB 3.85Å; S175-D198 WeakPolarHBondContact CA-OD2 3.41Å; S175-D198 WeakPolarHBondContact CB-OD2 3.34Å; S175-D198 PolarHBondContact OG-OD2 2.93Å; S176-D198 VanDerWaalsContact CB-OD1 3.31Å; S176-D198 WeakPolarHBondContact CB-OD1 3.49Å; S176-D198 PolarHBondContact N-OD2 3.5Å; S176-D198 PolarHBondContact OG-OD1 3.35Å; S176-D198 PolarHBondContact OG-OD2 3.2Å; N194-D198 PolarHBondContact O-N 2.82Å; N194-D198 VanDerWaalsContact O-N 3.14Å; C195-D198 PolarHBondContact O-N 3.31Å; D198-L200 VanDerWaalsContact C-N 3.29Å; D198-L200 PolarHBondContact O-N 2.89Å; D198-T201 PolarHBondContact O-N 2.89Å; D198-T201 PolarHBondContact O-OG1 3.29Å; D198-S202 PolarHBondContact O-N 3.26Å
199	L	98.6	Very high	97	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.4	-37.8	177.6	-74.2	166.9	0	0	0	112.2	A120 I145 C147 F173 C195 S197 T201 S202 W206 V209	A120-L199 HydrophobicContact CB-CD1 4.16Å; A120-L199 HydrophobicContact CB-CD2 4Å; I145-L199 HydrophobicContact CB-CD2 4.43Å; I145-L199 HydrophobicContact CD1-CD2 4.13Å; I145-L199 HydrophobicContact CG1-CD2 4.02Å; I145-L199 HydrophobicContact CG2-CD2 3.75Å; C147-L199 HydrophobicContact CB-CD1 4.07Å; C147-L199 HydrophobicContact CB-CD2 4.1Å; C147-L199 HydrophobicContact CB-CG 3.92Å; F173-L199 HydrophobicContact CE1-CD2 3.9Å; F173-L199 HydrophobicContact CZ-CD2 3.9Å; F173-L199 HydrophobicContact CZ-CG 4.13Å; C195-L199 WeakPolarHBondContact O-CB 3.45Å; C195-L199 WeakPolarHBondContact O-CD1 3.35Å; C195-L199 WeakPolarHBondContact O-CG 3.41Å; C195-L199 PolarHBondContact O-N 3.18Å; S197-L199 PolarHBondContact O-N 2.9Å; L199-T201 VanDerWaalsContact C-N 3.31Å; L199-T201 PolarHBondContact O-N 3.43Å; L199-S202 WeakPolarHBondContact O-CB 3.49Å; L199-S202 PolarHBondContact O-N 2.88Å; L199-S202 PolarHBondContact O-OG 2.83Å; L199-W206 HydrophobicContact CB-CZ2 4.13Å; L199-W206 PolarHBondContact O-NE1 3.3Å; L199-V209 HydrophobicContact CD1-CG2 3.9Å
200	L	97	Very high	97	Very high	27 Å²	27	40.8 Å²	40.8	14%	0.141	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-35.9	175.3	-84.8	-176.2	0	0	0	112.9	L196 S197 D198 S202 W206 R295 I298 Q299 N302	L196-L200 PolarHBondContact O-N 2.05Å; L196-L200 VanDerWaalsContact O-N 3.07Å; S197-L200 WeakPolarHBondContact O-CB 3.5Å; S197-L200 PolarHBondContact O-N 3.38Å; D198-L200 VanDerWaalsContact C-N 3.29Å; D198-L200 PolarHBondContact O-N 2.89Å; L200-S202 VanDerWaalsContact C-N 3.28Å; L200-W206 HydrophobicContact CD2-CH2 4.14Å; L200-W206 HydrophobicContact CD2-CZ2 3.85Å; L200-W206 HydrophobicContact CG-CZ2 4.34Å; L200-R295 HydrophobicContact CD2-CG 4.2Å; L200-I298 HydrophobicContact CD1-CB 4.4Å; L200-I298 HydrophobicContact CD1-CG2 3.61Å; L200-I298 HydrophobicContact CD2-CB 4.19Å; L200-I298 HydrophobicContact CD2-CG2 4.04Å; L200-I298 HydrophobicContact CG-CB 4.36Å; L200-I298 HydrophobicContact CG-CG2 3.66Å; L200-Q299 HydrophobicContact CD2-CG 3.68Å; L200-N302 HydrophobicContact CD1-CB 3.87Å
201	T	94.9	Very high	97.1	Very high	114 Å²	114	38.3 Å²	38.3	70%	0.699	19%	0.193	S	C	*	.	H	α-helix	trans	-76.9	-15.1	179.5	66.1	0	0	0	0	113.5	S197 D198 L199	S197-T201 PolarHBondContact O-N 2.74Å; D198-T201 PolarHBondContact O-N 2.89Å; D198-T201 PolarHBondContact O-OG1 3.29Å; L199-T201 VanDerWaalsContact C-N 3.31Å; L199-T201 PolarHBondContact O-N 3.43Å
202	S	91.9	Very high	97.1	Very high	22 Å²	22	38.3 Å²	38.3	15%	0.154	19%	0.193	C	C	.	.	S	Bend	trans	-65.1	151.1	179	76.7	0	0	0	0	112.7	I145 D198 L199 L200 F204	I145-S202 WeakPolarHBondContact CD1-OG 3.27Å; D198-S202 PolarHBondContact O-N 3.26Å; L199-S202 WeakPolarHBondContact O-CB 3.49Å; L199-S202 PolarHBondContact O-N 2.88Å; L199-S202 PolarHBondContact O-OG 2.83Å; L200-S202 VanDerWaalsContact C-N 3.28Å; S202-F204 PolarHBondContact O-N 3.32Å
203	E	90.1	Very high	97	Very high	189 Å²	189	39.3 Å²	39.3	88%	0.883	20%	0.2	S	C	*	.	S	Bend	trans	-69.4	-16.1	175.2	-59.9	-171.4	154.6	0	0	112.7	K205	E203-K205 PolarHBondContact O-N 3.29Å
204	F	91	Very high	97	Very high	71 Å²	71	38.5 Å²	38.5	31%	0.311	20%	0.199	S	C	.	.			trans	-67.3	119.1	178.5	-75.2	-106.2	0	0	0	110.1	I145 N171 S202 W206	I145-F204 HydrophobicContact CB-CB 4.2Å; I145-F204 HydrophobicContact CB-CD1 4.12Å; I145-F204 HydrophobicContact CB-CD2 4.42Å; I145-F204 HydrophobicContact CB-CG 4Å; I145-F204 HydrophobicContact CD1-CB 4.09Å; I145-F204 HydrophobicContact CD1-CD2 3.71Å; I145-F204 HydrophobicContact CD1-CE2 4.37Å; I145-F204 HydrophobicContact CD1-CG 3.99Å; I145-F204 HydrophobicContact CG1-CD2 4.36Å; I145-F204 HydrophobicContact CG1-CG 4.42Å; I145-F204 HydrophobicContact CG2-CB 4.11Å; I145-F204 HydrophobicContact CG2-CG 4.46Å; N171-F204 HydrophobicContact CB-CE1 4.27Å; N171-F204 HydrophobicContact CB-CZ 3.88Å; S202-F204 PolarHBondContact O-N 3.32Å; F204-W206 PolarHBondContact O-N 2.94Å
205	K	93.6	Very high	96.9	Very high	157 Å²	157	39.4 Å²	39.4	68%	0.683	20%	0.203	S	C	*	.			trans	-84.9	58	177.4	-62.1	-177.3	-177.1	176.6	0	111.4	E203	E203-K205 PolarHBondContact O-N 3.29Å
206	W	98.1	Very high	96.9	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.008	20%	0.203	C	C	.	.			trans	-63.5	157.4	178	55.5	-96.6	0	0	0	112.9	P118 A120 I145 L199 L200 F204 V209 R295 I298	P118-W206 HydrophobicContact CB-CB 4.22Å; P118-W206 CarbonylContact O-C 3.51Å; P118-W206 VanDerWaalsContact O-CA 3.29Å; P118-W206 WeakPolarHBondContact O-CA 3.48Å; P118-W206 WeakPolarHBondContact O-CB 3.47Å; A120-W206 HydrophobicContact CB-CB 4.03Å; A120-W206 HydrophobicContact CB-CD2 3.56Å; A120-W206 HydrophobicContact CB-CE3 3.91Å; A120-W206 HydrophobicContact CB-CG 3.6Å; I145-W206 HydrophobicContact CG2-CB 4.48Å; I145-W206 HydrophobicContact CG2-CG 4.3Å; L199-W206 HydrophobicContact CB-CZ2 4.13Å; L199-W206 PolarHBondContact O-NE1 3.3Å; L200-W206 HydrophobicContact CD2-CH2 4.14Å; L200-W206 HydrophobicContact CD2-CZ2 3.85Å; L200-W206 HydrophobicContact CG-CZ2 4.34Å; F204-W206 PolarHBondContact O-N 2.94Å; W206-V209 HydrophobicContact CE3-CB 4.39Å; W206-V209 HydrophobicContact CH2-CB 4.23Å; W206-V209 HydrophobicContact CH2-CG1 4.36Å; W206-V209 HydrophobicContact CZ3-CB 3.87Å; W206-V209 HydrophobicContact CZ3-CG1 4.15Å; W206-R295 HydrophobicContact CD2-CB 4.41Å; W206-R295 HydrophobicContact CD2-CG 4.26Å; W206-R295 HydrophobicContact CE3-CB 3.69Å; W206-R295 HydrophobicContact CE3-CG 3.99Å; W206-R295 HydrophobicContact CH2-CB 3.88Å; W206-R295 HydrophobicContact CH2-CG 3.68Å; W206-R295 HydrophobicContact CZ2-CG 3.96Å; W206-R295 HydrophobicContact CZ3-CB 3.4Å; W206-R295 HydrophobicContact CZ3-CG 3.71Å; W206-R295 WeakPolarHBondContact O-CD 3.44Å; W206-I298 HydrophobicContact CH2-CB 4.21Å; W206-I298 HydrophobicContact CH2-CG1 4.05Å
207	K	98.3	Very high	96.9	Very high	85 Å²	85	39.2 Å²	39.2	37%	0.37	20%	0.202	S	C	.	.	S	Bend	trans	-104.1	-43.4	-172.9	-59.5	-57.8	-174.6	178.7	0	112.4	F117 P118 R295	F117-K207 HydrophobicContact CD1-CB 4.33Å; F117-K207 HydrophobicContact CD1-CG 4.41Å; F117-K207 HydrophobicContact CD2-CB 4.26Å; F117-K207 HydrophobicContact CD2-CG 3.82Å; F117-K207 HydrophobicContact CE1-CB 3.99Å; F117-K207 HydrophobicContact CE1-CG 4.49Å; F117-K207 HydrophobicContact CE2-CB 3.93Å; F117-K207 HydrophobicContact CE2-CG 3.92Å; F117-K207 HydrophobicContact CG-CB 4.47Å; F117-K207 HydrophobicContact CG-CG 4.1Å; F117-K207 HydrophobicContact CZ-CB 3.8Å; F117-K207 HydrophobicContact CZ-CG 4.28Å; P118-K207 PolarHBondContact O-N 3.45Å; K207-R295 PolarHBondContact O-N 3.18Å
208	Y	98.8	Very high	96.9	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	151.6	177	-76.8	-89.1	0	0	0	110.4	F117 A120 L229 L232 G234 S235 V292 L293	F117-Y208 AromaticContact CE1-CD2 3.93Å; F117-Y208 HydrophobicContact CE1-CD2 3.93Å; F117-Y208 HydrophobicContact CE1-CE2 4.48Å; F117-Y208 AromaticContact CZ-CD2 3.63Å; F117-Y208 HydrophobicContact CZ-CD2 3.63Å; F117-Y208 AromaticContact CZ-CE2 3.76Å; F117-Y208 HydrophobicContact CZ-CE2 3.76Å; A120-Y208 PolarHBondContact N-O 2.9Å; Y208-L229 HydrophobicContact CD2-CB 4.17Å; Y208-L229 HydrophobicContact CE2-CB 4.47Å; Y208-L232 HydrophobicContact CD1-CD1 4.49Å; Y208-L232 HydrophobicContact CE1-CD1 3.91Å; Y208-L232 VanDerWaalsContact OH-CB 3.29Å; Y208-L232 WeakPolarHBondContact OH-CB 3.31Å; Y208-G234 WeakPolarHBondContact OH-CA 3.45Å; Y208-G234 PolarHBondContact OH-N 3.23Å; Y208-S235 WeakPolarHBondContact CE1-O 3.3Å; Y208-S235 PolarHBondContact OH-O 2.94Å; Y208-V292 HydrophobicContact CD1-CG1 3.67Å; Y208-V292 HydrophobicContact CE1-CG1 4.49Å; Y208-V292 HydrophobicContact CG-CG1 4.16Å; Y208-L293 CarbonylContact C-O 3.57Å; Y208-L293 VanDerWaalsContact CA-O 3.28Å; Y208-L293 WeakPolarHBondContact CA-O 3.43Å; Y208-L293 VanDerWaalsContact CD1-C 3.46Å; Y208-L293 WeakPolarHBondContact CD1-O 3.43Å
209	V	98.8	Very high	96.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.7	167.7	63.4	0	0	0	0	110.4	A120 L196 L199 W206 F291 V292 L293 I298	A120-V209 HydrophobicContact CB-CB 4.03Å; A120-V209 HydrophobicContact CB-CG2 3.98Å; A120-V209 CarbonylContact O-C 3.54Å; A120-V209 VanDerWaalsContact O-CA 3.26Å; A120-V209 WeakPolarHBondContact O-CA 3.37Å; L196-V209 HydrophobicContact CD2-CB 4.13Å; L196-V209 HydrophobicContact CD2-CG1 3.61Å; L196-V209 HydrophobicContact CD2-CG2 3.58Å; L199-V209 HydrophobicContact CD1-CG2 3.9Å; W206-V209 HydrophobicContact CE3-CB 4.39Å; W206-V209 HydrophobicContact CH2-CB 4.23Å; W206-V209 HydrophobicContact CH2-CG1 4.36Å; W206-V209 HydrophobicContact CZ3-CB 3.87Å; W206-V209 HydrophobicContact CZ3-CG1 4.15Å; V209-F291 HydrophobicContact CG1-CE2 4.25Å; V209-V292 WeakPolarHBondContact O-CA 3.38Å; V209-L293 HydrophobicContact CG1-CB 4.07Å; V209-L293 PolarHBondContact N-O 3.18Å; V209-L293 PolarHBondContact O-N 3.26Å; V209-I298 HydrophobicContact CG1-CD1 3.94Å; V209-I298 HydrophobicContact CG1-CG1 3.81Å
210	I	98.9	Very high	96.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.9	177.2	-48.5	-173	0	0	0	107.6	I119 A120 Y121 S122 L212 L225 L229 V292 F394	I119-I210 HydrophobicContact CG2-CD1 3.92Å; I119-I210 HydrophobicContact CG2-CG1 3.96Å; A120-I210 PolarHBondContact O-N 3.25Å; Y121-I210 VanDerWaalsContact CA-O 3.3Å; Y121-I210 WeakPolarHBondContact CA-O 3.43Å; Y121-I210 HydrophobicContact CD1-CB 3.94Å; Y121-I210 HydrophobicContact CD1-CG2 4.49Å; Y121-I210 HydrophobicContact CE1-CB 3.95Å; Y121-I210 HydrophobicContact CE1-CD1 3.96Å; Y121-I210 HydrophobicContact CE1-CG1 4.31Å; Y121-I210 HydrophobicContact CE1-CG2 4.38Å; S122-I210 PolarHBondContact N-O 3.32Å; I210-L212 HydrophobicContact CG2-CD2 4.11Å; I210-L212 HydrophobicContact CG2-CG 4.45Å; I210-L225 HydrophobicContact CD1-CD1 4.4Å; I210-L225 HydrophobicContact CD1-CD2 3.72Å; I210-L225 HydrophobicContact CD1-CG 4.38Å; I210-L229 HydrophobicContact CD1-CD1 4.2Å; I210-V292 HydrophobicContact CB-CG2 4.37Å; I210-V292 HydrophobicContact CD1-CG2 4.21Å; I210-V292 HydrophobicContact CG1-CG1 4.29Å; I210-V292 HydrophobicContact CG1-CG2 3.87Å; I210-V292 HydrophobicContact CG2-CG2 4.08Å; I210-F394 HydrophobicContact CD1-CE2 3.9Å; I210-F394 HydrophobicContact CD1-CZ 4.25Å; I210-F394 HydrophobicContact CG2-CD2 4.36Å; I210-F394 HydrophobicContact CG2-CE2 3.85Å; I210-F394 HydrophobicContact CG2-CZ 4.28Å
211	N	98.9	Very high	96.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	145.1	170.5	75.9	-28.7	0	0	0	111.6	S122 D192 A289 Y290 F291 R353	S122-N211 CarbonylContact O-C 3.59Å; S122-N211 VanDerWaalsContact O-CA 3.29Å; S122-N211 WeakPolarHBondContact O-CA 3.49Å; D192-N211 WeakPolarHBondContact OD1-CB 3.31Å; D192-N211 PolarHBondContact OD2-ND2 2.84Å; N211-A289 PolarHBondContact ND2-O 3.12Å; N211-Y290 VanDerWaalsContact OD1-CA 3.25Å; N211-Y290 WeakPolarHBondContact OD1-CA 3.31Å; N211-F291 HydrophobicContact CB-CD2 4.41Å; N211-F291 HydrophobicContact CB-CE1 3.95Å; N211-F291 HydrophobicContact CB-CE2 3.79Å; N211-F291 HydrophobicContact CB-CZ 3.54Å; N211-F291 VanDerWaalsContact CG-CE1 3.45Å; N211-F291 PolarHBondContact N-O 3.16Å; N211-F291 VanDerWaalsContact ND2-CE1 3.31Å; N211-F291 WeakPolarHBondContact ND2-CE1 3.45Å; N211-F291 PolarHBondContact OD1-N 3.2Å; N211-F291 PolarHBondContact OD1-O 2.93Å; N211-R353 PolarHBondContact O-NH2 3.11Å
212	L	98.9	Very high	96.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	153.5	-178.8	-57.7	174.5	0	0	0	109	Y121 S122 L123 V124 L135 V139 I210 D216 F394	Y121-L212 HydrophobicContact CD1-CD1 3.6Å; Y121-L212 HydrophobicContact CD1-CG 4.21Å; Y121-L212 HydrophobicContact CE1-CD1 4.02Å; S122-L212 PolarHBondContact O-N 3.38Å; L123-L212 WeakPolarHBondContact CA-O 3.31Å; V124-L212 PolarHBondContact N-O 2.92Å; L135-L212 HydrophobicContact CD1-CD1 4.14Å; L135-L212 HydrophobicContact CD2-CB 4.28Å; L135-L212 HydrophobicContact CD2-CD1 4.36Å; L135-L212 HydrophobicContact CG-CD1 4.41Å; V139-L212 HydrophobicContact CG1-CD1 4.46Å; I210-L212 HydrophobicContact CG2-CD2 4.11Å; I210-L212 HydrophobicContact CG2-CG 4.45Å; L212-D216 WeakPolarHBondContact CA-OD2 3.25Å; L212-D216 HydrophobicContact CD2-CB 4.24Å; L212-F394 HydrophobicContact CD1-CE1 4.15Å; L212-F394 HydrophobicContact CD2-CD1 3.56Å; L212-F394 HydrophobicContact CD2-CD2 4.41Å; L212-F394 HydrophobicContact CD2-CE1 3.67Å; L212-F394 HydrophobicContact CD2-CG 3.99Å; L212-F394 HydrophobicContact CD2-CZ 4.18Å
213	C	98.2	Very high	96.9	Very high	22 Å²	22	31.1 Å²	31.1	15%	0.149	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	165.9	165.8	76.6	0	0	0	0	110.7	V124 L135 Q215 D216 N396	V124-C213 WeakPolarHBondContact O-CA 3.05Å; L135-C213 VanDerWaalsContact CD2-O 3.3Å; L135-C213 WeakPolarHBondContact CD2-O 3.5Å; C213-Q215 PolarHBondContact O-N 2.99Å; C213-D216 PolarHBondContact N-OD2 3.03Å; C213-D216 WeakPolarHBondContact O-CB 3.44Å; C213-D216 PolarHBondContact O-N 2.85Å; C213-D216 VanDerWaalsContact SG-CG 3.53Å; C213-D216 PolarHBondContact SG-OD2 3.46Å; C213-N396 PolarHBondContact SG-ND2 2.92Å; C213-N396 VanDerWaalsContact SG-ND2 3.44Å
214	G	97.2	Very high	97.1	Very high	14 Å²	14	23.9 Å²	23.9	14%	0.144	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	0.8	-175.5	0	0	0	0	0	116.4	M131	M131-G214 WeakPolarHBondContact CG-O 3.4Å
215	Q	97.5	Very high	97.4	Very high	38 Å²	38	20.7 Å²	20.7	18%	0.178	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	11.2	175	-62.6	-165	-87.7	0	0	112.8	C213 K397 F398	C213-Q215 PolarHBondContact O-N 2.99Å; Q215-K397 HydrophobicContact CB-CB 4.35Å; Q215-K397 HydrophobicContact CB-CG 4.4Å; Q215-F398 PolarHBondContact NE2-O 2.86Å; Q215-F398 PolarHBondContact O-N 2.85Å
216	D	98.8	Very high	97.6	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	158.2	170.2	-69.7	-38.2	0	0	0	111.2	L135 L212 C213 R353 A395 N396	L135-D216 WeakPolarHBondContact CD1-O 3.08Å; L135-D216 HydrophobicContact CD2-CB 4.39Å; L212-D216 WeakPolarHBondContact CA-OD2 3.25Å; L212-D216 HydrophobicContact CD2-CB 4.24Å; C213-D216 PolarHBondContact N-OD2 3.03Å; C213-D216 WeakPolarHBondContact O-CB 3.44Å; C213-D216 PolarHBondContact O-N 2.85Å; C213-D216 VanDerWaalsContact SG-CG 3.53Å; C213-D216 PolarHBondContact SG-OD2 3.46Å; D216-R353 VanDerWaalsContact CB-NH1 3.3Å; D216-R353 WeakPolarHBondContact OD1-CD 3.49Å; D216-R353 IonicContact OD1-CZ 2.58Å; D216-R353 IonicContact OD1-NE 3.27Å; D216-R353 PolarHBondContact OD1-NE 3.19Å; D216-R353 IonicContact OD1-NH1 3.93Å; D216-R353 PolarHBondContact OD1-NH1 3.16Å; D216-R353 IonicContact OD2-CZ 2.68Å; D216-R353 IonicContact OD2-NE 3.98Å; D216-R353 IonicContact OD2-NH1 3.54Å; D216-R353 PolarHBondContact OD2-NH1 3.27Å; D216-R353 IonicContact OD2-NH2 3.04Å; D216-R353 PolarHBondContact OD2-NH2 3.28Å; D216-A395 WeakPolarHBondContact CA-O 3.38Å; D216-N396 VanDerWaalsContact OD1-CB 3.27Å; D216-N396 WeakPolarHBondContact OD1-CB 3.29Å; D216-N396 PolarHBondContact OD1-ND2 3.02Å
217	F	98.8	Very high	97.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	143.3	168.3	-144.1	-100.8	0	0	0	111	M131 R134 A138 F394 A395 F398 L407 L410 E411 L414	M131-F217 HydrophobicContact CE-CD2 3.83Å; M131-F217 HydrophobicContact CE-CE2 4.47Å; R134-F217 HydrophobicContact CB-CE2 4.2Å; A138-F217 HydrophobicContact CB-CE1 4.05Å; A138-F217 HydrophobicContact CB-CE2 4.21Å; A138-F217 HydrophobicContact CB-CZ 3.66Å; F217-F394 WeakPolarHBondContact O-CA 3.47Å; F217-A395 PolarHBondContact N-O 2.96Å; F217-A395 PolarHBondContact O-N 2.99Å; F217-F398 HydrophobicContact CB-CD1 4.41Å; F217-F398 HydrophobicContact CB-CD2 3.33Å; F217-F398 HydrophobicContact CB-CE1 4.41Å; F217-F398 HydrophobicContact CB-CE2 3.31Å; F217-F398 HydrophobicContact CB-CG 3.91Å; F217-F398 HydrophobicContact CB-CZ 3.89Å; F217-L407 HydrophobicContact CD1-CD2 4.41Å; F217-L407 HydrophobicContact CD2-CD2 3.61Å; F217-L407 HydrophobicContact CE2-CD2 3.83Å; F217-L407 HydrophobicContact CG-CD2 3.92Å; F217-L407 HydrophobicContact CZ-CD2 4.33Å; F217-L410 HydrophobicContact CD1-CB 3.89Å; F217-L410 HydrophobicContact CD1-CD1 3.93Å; F217-L410 HydrophobicContact CD1-CG 4.5Å; F217-L410 HydrophobicContact CE1-CB 3.8Å; F217-E411 HydrophobicContact CE1-CG 4.03Å; F217-E411 HydrophobicContact CZ-CG 3.57Å; F217-L414 HydrophobicContact CE1-CD1 4.14Å
218	P	98.6	Very high	97.4	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.013	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	149.5	175.6	25.9	-34.3	0	0	0	112.4	A138 V139 F394 L414	A138-P218 HydrophobicContact CB-CG 3.66Å; V139-P218 HydrophobicContact CG1-CB 4.13Å; V139-P218 HydrophobicContact CG1-CG 3.83Å; P218-F394 VanDerWaalsContact CA-CD1 3.48Å; P218-F394 HydrophobicContact CB-CD1 3.95Å; P218-F394 HydrophobicContact CB-CE1 3.74Å; P218-L414 HydrophobicContact CB-CD1 4.21Å; P218-L414 HydrophobicContact CG-CD1 3.73Å
219	L	98.6	Very high	97.4	Very high	1 Å²	1	15 Å²	15	1%	0.005	9%	0.085	C	C	.	.	S	Bend	trans	-113.5	-5.3	171.7	-59.6	178	0	0	0	112.2	L354 L387 H392 W393 A395 L410	L219-L354 HydrophobicContact CD1-CB 4.49Å; L219-L354 HydrophobicContact CD1-CD2 4.35Å; L219-L387 WeakPolarHBondContact CD1-O 3.05Å; L219-L387 HydrophobicContact CD2-CB 3.9Å; L219-H392 HydrophobicContact CD1-CB 4.2Å; L219-W393 PolarHBondContact N-O 2.9Å; L219-A395 HydrophobicContact CD1-CB 3.82Å; L219-A395 HydrophobicContact CD2-CB 4.06Å; L219-A395 HydrophobicContact CG-CB 4.05Å; L219-L410 HydrophobicContact CD2-CD2 4.1Å
220	K	97.6	Very high	97.3	Very high	33 Å²	33	20.5 Å²	20.5	14%	0.143	11%	0.106	C	C	.	.	S	Bend	trans	-126.4	143.2	180	-62.4	-60.9	-173.5	-179.9	0	109.6	E224 L225 L414	K220-E224 WeakPolarHBondContact CA-OE2 3.41Å; K220-E224 HydrophobicContact CB-CB 3.92Å; K220-E224 HydrophobicContact CD-CB 4.14Å; K220-E224 HydrophobicContact CG-CB 4.47Å; K220-L225 HydrophobicContact CB-CB 4.45Å; K220-L414 VanDerWaalsContact C-CD2 3.41Å
221	S	95.7	Very high	97.2	Very high	5 Å²	5	23 Å²	23	4%	0.035	13%	0.131	C	C	.	.			trans	-65.4	163.5	168.1	75.5	0	0	0	0	110.5	M223 E224 L225 Q418	S221-M223 PolarHBondContact O-N 3.16Å; S221-E224 PolarHBondContact N-OE2 3.48Å; S221-E224 PolarHBondContact O-N 3.33Å; S221-E224 PolarHBondContact OG-N 3.41Å; S221-L225 WeakPolarHBondContact O-CB 3.49Å; S221-L225 PolarHBondContact O-N 2.93Å; S221-Q418 PolarHBondContact OG-OE1 2.95Å
222	N	95.9	Very high	97.1	Very high	16 Å²	16	24.1 Å²	24.1	9%	0.086	14%	0.137	C	C	.	.	H	α-helix	trans	-57.4	-39.9	177.6	-176.8	76.1	0	0	0	111.5	E114 N144 L225 V226	E114-N222 WeakPolarHBondContact CG-ND2 3.32Å; E114-N222 PolarHBondContact OE1-ND2 3.26Å; N144-N222 PolarHBondContact ND2-OD1 2.91Å; N222-L225 PolarHBondContact O-N 3.34Å; N222-V226 VanDerWaalsContact O-CG2 3.31Å; N222-V226 WeakPolarHBondContact O-CG2 3.01Å; N222-V226 PolarHBondContact O-N 3.13Å
223	M	92.3	Very high	97	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.044	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-50.6	174.9	178.3	66.5	86.6	0	0	113	S111 E113 E114 S221 L225 V226 S227 F421	S111-M223 WeakPolarHBondContact OG-CE 3.49Å; E113-M223 HydrophobicContact CB-SD 4.47Å; E113-M223 HydrophobicContact CG-SD 4.28Å; E114-M223 HydrophobicContact CG-CB 4.41Å; E114-M223 HydrophobicContact CG-CE 4.18Å; E114-M223 HydrophobicContact CG-SD 4.03Å; E114-M223 PolarHBondContact OE1-N 3.33Å; S221-M223 PolarHBondContact O-N 3.16Å; M223-L225 PolarHBondContact O-N 3.4Å; M223-V226 PolarHBondContact O-N 3.28Å; M223-S227 PolarHBondContact O-N 2.99Å; M223-F421 HydrophobicContact CG-CD1 4.03Å; M223-F421 HydrophobicContact CG-CE1 4.41Å; M223-F421 HydrophobicContact CG-CG 4.29Å
224	E	95.3	Very high	96.9	Very high	37 Å²	37	33.6 Å²	33.6	17%	0.173	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-41.8	177.5	-77.8	176.8	118.6	0	0	110.2	K220 S221 S227 E228 K417	K220-E224 WeakPolarHBondContact CA-OE2 3.41Å; K220-E224 HydrophobicContact CB-CB 3.92Å; K220-E224 HydrophobicContact CD-CB 4.14Å; K220-E224 HydrophobicContact CG-CB 4.47Å; S221-E224 PolarHBondContact N-OE2 3.48Å; S221-E224 PolarHBondContact O-N 3.33Å; S221-E224 PolarHBondContact OG-N 3.41Å; E224-S227 PolarHBondContact O-N 3.43Å; E224-E228 VanDerWaalsContact O-CG 3.29Å; E224-E228 WeakPolarHBondContact O-CG 3.39Å; E224-E228 PolarHBondContact O-N 2.92Å; E224-K417 IonicContact OE1-NZ 2.68Å; E224-K417 PolarHBondContact OE1-NZ 2.77Å; E224-K417 WeakPolarHBondContact OE2-CD 3.28Å; E224-K417 IonicContact OE2-NZ 2.98Å; E224-K417 PolarHBondContact OE2-NZ 3.27Å
225	L	97.3	Very high	96.8	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-46.8	178.3	-172.8	59.2	0	0	0	111.8	I119 Y121 I210 K220 S221 N222 M223 S227 E228 L229 W393 F394	I119-L225 HydrophobicContact CD1-CD2 4.1Å; I119-L225 HydrophobicContact CD1-CG 4.14Å; Y121-L225 WeakPolarHBondContact OH-CD2 3.16Å; I210-L225 HydrophobicContact CD1-CD1 4.4Å; I210-L225 HydrophobicContact CD1-CD2 3.72Å; I210-L225 HydrophobicContact CD1-CG 4.38Å; K220-L225 HydrophobicContact CB-CB 4.45Å; S221-L225 WeakPolarHBondContact O-CB 3.49Å; S221-L225 PolarHBondContact O-N 2.93Å; N222-L225 PolarHBondContact O-N 3.34Å; M223-L225 PolarHBondContact O-N 3.4Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 2.86Å; L225-E228 PolarHBondContact O-N 3.49Å; L225-L229 HydrophobicContact CD1-CD1 4.19Å; L225-L229 HydrophobicContact CD1-CD2 4.35Å; L225-L229 HydrophobicContact CD1-CG 4.04Å; L225-L229 HydrophobicContact CG-CD1 3.97Å; L225-L229 HydrophobicContact CG-CG 4.22Å; L225-L229 WeakPolarHBondContact O-CB 3.43Å; L225-L229 WeakPolarHBondContact O-CG 3.35Å; L225-L229 PolarHBondContact O-N 3.05Å; L225-W393 HydrophobicContact CD1-CB 3.87Å; L225-W393 HydrophobicContact CD1-CD2 3.92Å; L225-W393 HydrophobicContact CD1-CE3 4.39Å; L225-W393 HydrophobicContact CD1-CG 3.68Å; L225-F394 HydrophobicContact CD1-CE2 4.49Å; L225-F394 HydrophobicContact CD2-CE2 4.01Å; L225-F394 HydrophobicContact CD2-CZ 3.92Å
226	V	97.1	Very high	96.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-55	-47.6	174.5	165.2	0	0	0	0	110.9	E113 E114 F117 I119 N222 M223 E228 L229 R230	E113-V226 HydrophobicContact CG-CG1 3.67Å; E114-V226 HydrophobicContact CG-CG2 4.16Å; F117-V226 HydrophobicContact CB-CG1 3.7Å; F117-V226 HydrophobicContact CD1-CB 4.37Å; F117-V226 HydrophobicContact CD1-CG1 3.93Å; F117-V226 HydrophobicContact CD1-CG2 4.16Å; F117-V226 HydrophobicContact CG-CG1 3.95Å; I119-V226 HydrophobicContact CD1-CG2 3.88Å; I119-V226 HydrophobicContact CG1-CG2 4.49Å; N222-V226 VanDerWaalsContact O-CG2 3.31Å; N222-V226 WeakPolarHBondContact O-CG2 3.01Å; N222-V226 PolarHBondContact O-N 3.13Å; M223-V226 PolarHBondContact O-N 3.28Å; V226-E228 PolarHBondContact O-N 2.81Å; V226-L229 PolarHBondContact O-N 3.24Å; V226-R230 HydrophobicContact CG1-CG 4.41Å; V226-R230 WeakPolarHBondContact O-CB 3.31Å; V226-R230 VanDerWaalsContact O-CG 3.27Å; V226-R230 WeakPolarHBondContact O-CG 3.3Å; V226-R230 PolarHBondContact O-N 2.75Å
227	S	95.3	Very high	96.6	Very high	70 Å²	70	36 Å²	36	49%	0.49	20%	0.2	S	C	.	.	H	α-helix	trans	-58.9	-46.3	177.7	177.9	0	0	0	0	112.1	M223 E224 L225 G231	M223-S227 PolarHBondContact O-N 2.99Å; E224-S227 PolarHBondContact O-N 3.43Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 2.86Å; S227-G231 PolarHBondContact O-N 3.49Å
228	E	97.2	Very high	96.6	Very high	62 Å²	62	36.2 Å²	36.2	29%	0.29	20%	0.201	S	C	.	.	H	α-helix	trans	-63.5	-44.5	177.6	-73.5	-87.1	174.3	0	0	112.1	E224 L225 V226 G231 K351 W393	E224-E228 VanDerWaalsContact O-CG 3.29Å; E224-E228 WeakPolarHBondContact O-CG 3.39Å; E224-E228 PolarHBondContact O-N 2.92Å; L225-E228 PolarHBondContact O-N 3.49Å; V226-E228 PolarHBondContact O-N 2.81Å; E228-G231 WeakPolarHBondContact O-CA 3.48Å; E228-G231 PolarHBondContact O-N 2.98Å; E228-G231 VanDerWaalsContact O-N 3.08Å; E228-K351 IonicContact OE1-NZ 3.92Å; E228-K351 PolarHBondContact OE1-NZ 3.24Å; E228-K351 IonicContact OE2-NZ 3.43Å; E228-K351 PolarHBondContact OE2-NZ 3.41Å; E228-W393 HydrophobicContact CB-CZ2 4.17Å
229	L	98.3	Very high	96.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.5	-33.3	-179.1	-65.9	-176.2	0	0	0	113	F117 I119 Y208 I210 L225 V226 G231 L232 V292 W393	F117-L229 HydrophobicContact CE1-CB 3.6Å; F117-L229 HydrophobicContact CE1-CD1 4.36Å; F117-L229 HydrophobicContact CZ-CB 3.95Å; I119-L229 HydrophobicContact CD1-CD1 3.73Å; I119-L229 HydrophobicContact CG1-CD1 4.08Å; Y208-L229 HydrophobicContact CD2-CB 4.17Å; Y208-L229 HydrophobicContact CE2-CB 4.47Å; I210-L229 HydrophobicContact CD1-CD1 4.2Å; L225-L229 HydrophobicContact CD1-CD1 4.19Å; L225-L229 HydrophobicContact CD1-CD2 4.35Å; L225-L229 HydrophobicContact CD1-CG 4.04Å; L225-L229 HydrophobicContact CG-CD1 3.97Å; L225-L229 HydrophobicContact CG-CG 4.22Å; L225-L229 WeakPolarHBondContact O-CB 3.43Å; L225-L229 WeakPolarHBondContact O-CG 3.35Å; L225-L229 PolarHBondContact O-N 3.05Å; V226-L229 PolarHBondContact O-N 3.24Å; L229-G231 PolarHBondContact O-N 3.33Å; L229-L232 HydrophobicContact CD2-CD1 3.71Å; L229-L232 WeakPolarHBondContact O-CB 3.48Å; L229-L232 PolarHBondContact O-N 2.88Å; L229-L232 VanDerWaalsContact O-N 3.16Å; L229-V292 HydrophobicContact CD2-CG1 3.63Å; L229-W393 HydrophobicContact CD2-CE3 4.3Å; L229-W393 HydrophobicContact CD2-CH2 3.77Å; L229-W393 HydrophobicContact CD2-CZ2 4.18Å; L229-W393 HydrophobicContact CD2-CZ3 3.83Å
230	R	97.1	Very high	96.6	Very high	116 Å²	116	37.8 Å²	37.8	44%	0.438	21%	0.208	S	C	.	.	H	α-helix	trans	-59.7	-37.8	169.2	-75.6	179.4	72.4	168.9	5.1	111.3	E113 F117 V226 L232 K233	E113-R230 WeakPolarHBondContact OE1-CD 3.26Å; E113-R230 IonicContact OE1-CZ 3.41Å; E113-R230 IonicContact OE1-NE 3.33Å; E113-R230 IonicContact OE1-NH1 3.13Å; E113-R230 PolarHBondContact OE1-NH1 2.88Å; E113-R230 IonicContact OE2-NH1 3.61Å; F117-R230 HydrophobicContact CD1-CG 4.42Å; F117-R230 HydrophobicContact CD2-CG 3.46Å; F117-R230 VanDerWaalsContact CD2-CG 3.46Å; F117-R230 HydrophobicContact CE1-CG 4.37Å; F117-R230 HydrophobicContact CE2-CB 4.32Å; F117-R230 HydrophobicContact CE2-CG 3.39Å; F117-R230 HydrophobicContact CG-CG 3.99Å; F117-R230 HydrophobicContact CZ-CG 3.86Å; V226-R230 HydrophobicContact CG1-CG 4.41Å; V226-R230 WeakPolarHBondContact O-CB 3.31Å; V226-R230 VanDerWaalsContact O-CG 3.27Å; V226-R230 WeakPolarHBondContact O-CG 3.3Å; V226-R230 PolarHBondContact O-N 2.75Å; R230-L232 PolarHBondContact O-N 3.25Å; R230-K233 PolarHBondContact O-N 2.72Å; R230-K233 VanDerWaalsContact O-N 3.17Å
231	G	97.1	Very high	96.6	Very high	53 Å²	53	37 Å²	37	55%	0.546	21%	0.206	S	C	.	.	H	α-helix	trans	-60.2	-23.4	176.2	0	0	0	0	0	114.2	S227 E228 L229 K233	S227-G231 PolarHBondContact O-N 3.49Å; E228-G231 WeakPolarHBondContact O-CA 3.48Å; E228-G231 PolarHBondContact O-N 2.98Å; E228-G231 VanDerWaalsContact O-N 3.08Å; L229-G231 PolarHBondContact O-N 3.33Å; G231-K233 VanDerWaalsContact C-N 3.29Å; G231-K233 PolarHBondContact O-N 2.89Å
232	L	97.1	Very high	96.7	Very high	25 Å²	25	41.9 Å²	41.9	13%	0.131	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-18.9	177.6	-60.2	179.2	0	0	0	113.7	Y208 L229 R230 G234 S235 M237 V292 W393	Y208-L232 HydrophobicContact CD1-CD1 4.49Å; Y208-L232 HydrophobicContact CE1-CD1 3.91Å; Y208-L232 VanDerWaalsContact OH-CB 3.29Å; Y208-L232 WeakPolarHBondContact OH-CB 3.31Å; L229-L232 HydrophobicContact CD2-CD1 3.71Å; L229-L232 WeakPolarHBondContact O-CB 3.48Å; L229-L232 PolarHBondContact O-N 2.88Å; L229-L232 VanDerWaalsContact O-N 3.16Å; R230-L232 PolarHBondContact O-N 3.25Å; L232-G234 PolarHBondContact O-N 3.19Å; L232-S235 VanDerWaalsContact O-CB 3.25Å; L232-S235 WeakPolarHBondContact O-CB 3.37Å; L232-S235 PolarHBondContact O-N 3.29Å; L232-S235 PolarHBondContact O-OG 2.89Å; L232-M237 HydrophobicContact CD1-CB 4.31Å; L232-M237 HydrophobicContact CD2-CE 3.9Å; L232-V292 HydrophobicContact CD1-CG1 4.49Å; L232-W393 HydrophobicContact CD1-CH2 3.88Å; L232-W393 HydrophobicContact CD2-CH2 4.23Å; L232-W393 HydrophobicContact CG-CH2 4.41Å
233	K	96.3	Very high	96.8	Very high	190 Å²	190	42.3 Å²	42.3	83%	0.826	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	35.1	174.4	-60.6	177	-178.5	177.7	0	115.2	R230 G231	R230-K233 PolarHBondContact O-N 2.72Å; R230-K233 VanDerWaalsContact O-N 3.17Å; G231-K233 VanDerWaalsContact C-N 3.29Å; G231-K233 PolarHBondContact O-N 2.89Å
234	G	95.3	Very high	97.1	Very high	31 Å²	31	44.8 Å²	44.8	32%	0.32	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	99	-11	178.9	0	0	0	0	0	114.3	Y208 L232 S294 G336	Y208-G234 WeakPolarHBondContact OH-CA 3.45Å; Y208-G234 PolarHBondContact OH-N 3.23Å; L232-G234 PolarHBondContact O-N 3.19Å; G234-S294 PolarHBondContact O-OG 2.83Å; G234-G336 WeakPolarHBondContact O-CA 3.34Å
235	S	95.9	Very high	97.2	Very high	57 Å²	57	49 Å²	49	40%	0.399	27%	0.266	S	S	.	.			trans	-71	145.8	175.5	-60.1	0	0	0	0	112.2	Y208 L232	Y208-S235 WeakPolarHBondContact CE1-O 3.3Å; Y208-S235 PolarHBondContact OH-O 2.94Å; L232-S235 VanDerWaalsContact O-CB 3.25Å; L232-S235 WeakPolarHBondContact O-CB 3.37Å; L232-S235 PolarHBondContact O-N 3.29Å; L232-S235 PolarHBondContact O-OG 2.89Å
236	S	94.9	Very high	97.1	Very high	8 Å²	8	55.5 Å²	55.5	6%	0.056	30%	0.296	C	S	.	.			trans	-82.4	158.2	172	-68.1	0	0	0	0	111.5	G336	S236-G336 PolarHBondContact N-O 3.43Å
237	M	97.1	Very high	97	Very high	38 Å²	38	57.7 Å²	57.7	19%	0.187	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.1	175.2	-179.2	63.2	66.6	0	0	109.3	L232 V292 T352 W393	L232-M237 HydrophobicContact CD1-CB 4.31Å; L232-M237 HydrophobicContact CD2-CE 3.9Å; M237-V292 HydrophobicContact CB-CB 4.38Å; M237-V292 PolarHBondContact N-O 2.84Å; M237-V292 PolarHBondContact O-N 3.44Å; M237-T352 HydrophobicContact CB-CG2 4.27Å; M237-T352 HydrophobicContact CG-CG2 3.82Å; M237-T352 WeakPolarHBondContact O-CG2 3.45Å; M237-W393 HydrophobicContact CB-CH2 3.87Å; M237-W393 HydrophobicContact CB-CZ3 3.91Å; M237-W393 HydrophobicContact CG-CH2 3.69Å; M237-W393 HydrophobicContact CG-CZ3 3.72Å
238	L	98.2	Very high	97.2	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	164	174.6	57.4	160.3	0	0	0	109.9	F291 L293 W325 V329 S350	L238-F291 HydrophobicContact CB-CB 4.15Å; L238-L293 HydrophobicContact CD2-CD2 3.89Å; L238-W325 HydrophobicContact CD1-CB 3.64Å; L238-V329 HydrophobicContact CD1-CB 4.33Å; L238-V329 HydrophobicContact CD1-CG1 4.07Å; L238-V329 HydrophobicContact CD2-CB 3.85Å; L238-V329 HydrophobicContact CD2-CG1 3.97Å; L238-V329 HydrophobicContact CD2-CG2 3.69Å; L238-V329 HydrophobicContact CG-CB 4.44Å; L238-V329 HydrophobicContact CG-CG1 4.08Å; L238-S350 VanDerWaalsContact C-OG 3.28Å; L238-S350 WeakPolarHBondContact CA-OG 3.35Å
239	E	98.6	Very high	97.1	Very high	36 Å²	36	57.6 Å²	57.6	17%	0.168	30%	0.296	C	S	.	.			trans	-66.6	131.6	169.1	-174.6	-172	167.7	0	0	109.7	N288 I345 S350	E239-N288 WeakPolarHBondContact OE2-CB 3.43Å; E239-N288 PolarHBondContact OE2-N 2.88Å; E239-N288 PolarHBondContact OE2-ND2 2.94Å; E239-I345 WeakPolarHBondContact CA-O 3.3Å; E239-I345 WeakPolarHBondContact CG-O 3.29Å; E239-S350 PolarHBondContact N-OG 2.89Å
240	T	98.6	Very high	97.1	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-154.8	110.3	174.2	174.9	0	0	0	0	110.4	I286 A326 V329 R330 V338 I345	T240-I286 CarbonylContact C-O 3.58Å; T240-I286 WeakPolarHBondContact CA-O 3.37Å; T240-A326 PolarHBondContact OG1-O 3.49Å; T240-V329 HydrophobicContact CG2-CG1 3.76Å; T240-R330 HydrophobicContact CG2-CG 4.35Å; T240-R330 PolarHBondContact O-NH2 3.29Å; T240-R330 WeakPolarHBondContact OG1-CD 3.38Å; T240-R330 WeakPolarHBondContact OG1-CG 2.87Å; T240-R330 PolarHBondContact OG1-NE 3.03Å; T240-V338 HydrophobicContact CG2-CG1 4.41Å; T240-I345 HydrophobicContact CG2-CB 4.16Å; T240-I345 HydrophobicContact CG2-CD1 4.02Å; T240-I345 HydrophobicContact CG2-CG1 4.29Å; T240-I345 PolarHBondContact N-O 3.06Å; T240-I345 PolarHBondContact O-N 3.04Å
241	S	98.4	Very high	97.1	Very high	15 Å²	15	54.9 Å²	54.9	11%	0.105	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-135.1	158.9	-173.3	-59.1	0	0	0	0	111.1	F285 I286 I345	S241-F285 WeakPolarHBondContact O-CA 3.03Å; S241-I286 PolarHBondContact N-O 2.77Å; S241-I286 WeakPolarHBondContact O-CG1 3.08Å; S241-I286 PolarHBondContact O-N 2.96Å; S241-I345 PolarHBondContact OG-O 2.9Å
242	R	98.4	Very high	97.2	Very high	109 Å²	109	56 Å²	56	41%	0.411	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-66.9	140.6	175.7	-72.7	166.9	175.2	82.6	0.8	110.1	S244 F285 R340 D344	R242-S244 PolarHBondContact O-N 2.88Å; R242-F285 HydrophobicContact CG-CD1 4.32Å; R242-F285 HydrophobicContact CG-CE1 3.96Å; R242-R340 PolarHBondContact NH2-O 2.94Å; R242-D344 IonicContact CZ-OD1 3.72Å; R242-D344 VanDerWaalsContact N-CG 3.3Å; R242-D344 PolarHBondContact N-OD1 3.15Å; R242-D344 PolarHBondContact N-OD2 3.49Å; R242-D344 IonicContact NH1-OD1 3.92Å; R242-D344 PolarHBondContact NH1-OD1 3.38Å
243	P	97.8	Very high	97.2	Very high	24 Å²	24	58.3 Å²	58.3	16%	0.156	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.8	131	-175.5	28.8	-34.5	0	0	0	111.9	K248 F251 M284 I286	P243-K248 HydrophobicContact CB-CG 3.82Å; P243-K248 HydrophobicContact CG-CG 3.99Å; P243-K248 WeakPolarHBondContact O-CE 3.49Å; P243-F251 HydrophobicContact CB-CE1 4.22Å; P243-F251 HydrophobicContact CB-CZ 3.98Å; P243-F251 HydrophobicContact CG-CZ 4.1Å; P243-M284 VanDerWaalsContact CD-O 3.26Å; P243-M284 WeakPolarHBondContact CD-O 3.28Å; P243-I286 HydrophobicContact CB-CG1 4.4Å; P243-I286 HydrophobicContact CB-CG2 3.84Å
244	S	97.1	Very high	97.3	Very high	62 Å²	62	53.3 Å²	53.3	43%	0.434	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-67.1	158.3	165	69.3	0	0	0	0	111.2	R242 H246 K247 K248	R242-S244 PolarHBondContact O-N 2.88Å; S244-H246 PolarHBondContact O-N 3.5Å; S244-H246 VanDerWaalsContact O-N 3.16Å; S244-K247 PolarHBondContact O-N 2.93Å; S244-K247 PolarHBondContact OG-N 3.12Å; S244-K248 WeakPolarHBondContact O-CG 3.37Å; S244-K248 PolarHBondContact O-N 3.13Å
245	E	97	Very high	97.5	Very high	126 Å²	126	53.2 Å²	53.2	59%	0.589	25%	0.253	S	S	*	.	H	α-helix	trans	-54.3	-37.6	178	-66.8	-50.8	124.7	0	0	112.9	K248	E245-K248 PolarHBondContact O-N 2.99Å; E245-K248 WeakPolarHBondContact OE1-CE 3.35Å; E245-K248 IonicContact OE1-NZ 3.29Å; E245-K248 PolarHBondContact OE1-NZ 2.86Å; E245-K248 IonicContact OE2-NZ 3.62Å
246	H	95.4	Very high	97.5	Very high	139 Å²	139	54.4 Å²	54.4	64%	0.644	25%	0.252	S	S	*	.	H	α-helix	trans	-64.8	-45.8	175	177.5	-94	0	0	0	112.2	S244 K248 Q249	S244-H246 PolarHBondContact O-N 3.5Å; S244-H246 VanDerWaalsContact O-N 3.16Å; H246-K248 VanDerWaalsContact C-N 3.34Å; H246-K248 PolarHBondContact O-N 3.24Å; H246-Q249 WeakPolarHBondContact O-CB 3.31Å; H246-Q249 PolarHBondContact O-N 3.21Å
247	K	96.8	Very high	97.6	Very high	46 Å²	46	57.7 Å²	57.7	20%	0.2	27%	0.269	C	S	.	.	H	α-helix	trans	-71.2	-28.1	179.9	-75.5	-105.4	-174.5	161.9	0	112.2	S244 Q249 R250 I286 E322	S244-K247 PolarHBondContact O-N 2.93Å; S244-K247 PolarHBondContact OG-N 3.12Å; K247-Q249 PolarHBondContact O-N 3.39Å; K247-R250 VanDerWaalsContact O-CB 3.3Å; K247-R250 WeakPolarHBondContact O-CB 3.43Å; K247-R250 PolarHBondContact O-N 3.19Å; K247-R250 VanDerWaalsContact O-N 3.15Å; K247-I286 HydrophobicContact CB-CD1 3.89Å; K247-I286 HydrophobicContact CB-CG2 4.19Å; K247-I286 HydrophobicContact CD-CD1 3.94Å; K247-I286 HydrophobicContact CG-CD1 3.8Å; K247-E322 IonicContact NZ-OE2 3.57Å; K247-E322 PolarHBondContact NZ-OE2 3.45Å
248	K	97.6	Very high	97.6	Very high	65 Å²	65	60.4 Å²	60.4	28%	0.283	28%	0.281	S	S	.	.	H	α-helix	trans	-56.7	-36.2	172.1	-70.2	178.9	-175.8	170.3	0	112.5	P243 S244 E245 H246 R250 F251 L252	P243-K248 HydrophobicContact CB-CG 3.82Å; P243-K248 HydrophobicContact CG-CG 3.99Å; P243-K248 WeakPolarHBondContact O-CE 3.49Å; S244-K248 WeakPolarHBondContact O-CG 3.37Å; S244-K248 PolarHBondContact O-N 3.13Å; E245-K248 PolarHBondContact O-N 2.99Å; E245-K248 WeakPolarHBondContact OE1-CE 3.35Å; E245-K248 IonicContact OE1-NZ 3.29Å; E245-K248 PolarHBondContact OE1-NZ 2.86Å; E245-K248 IonicContact OE2-NZ 3.62Å; H246-K248 VanDerWaalsContact C-N 3.34Å; H246-K248 PolarHBondContact O-N 3.24Å; K248-R250 PolarHBondContact O-N 2.88Å; K248-F251 HydrophobicContact CB-CE2 4.31Å; K248-F251 HydrophobicContact CB-CZ 4.1Å; K248-F251 HydrophobicContact CG-CE2 4.35Å; K248-F251 HydrophobicContact CG-CZ 3.91Å; K248-F251 PolarHBondContact O-N 2.76Å; K248-F251 VanDerWaalsContact O-N 3.09Å; K248-L252 HydrophobicContact CB-CD1 3.9Å; K248-L252 HydrophobicContact CB-CG 4.38Å; K248-L252 VanDerWaalsContact O-CG 3.29Å; K248-L252 WeakPolarHBondContact O-CG 3.38Å; K248-L252 PolarHBondContact O-N 2.83Å; K248-L252 VanDerWaalsContact O-N 3.09Å
249	Q	96.8	Very high	97.4	Very high	65 Å²	65	66.8 Å²	66.8	30%	0.304	32%	0.315	S	S	.	.	H	α-helix	trans	-56.7	-26.1	179.7	-63.3	-57.8	-51.5	0	0	113.5	H246 K247 F251 Y253 Y255	H246-Q249 WeakPolarHBondContact O-CB 3.31Å; H246-Q249 PolarHBondContact O-N 3.21Å; K247-Q249 PolarHBondContact O-N 3.39Å; Q249-F251 VanDerWaalsContact C-N 3.26Å; Q249-F251 PolarHBondContact O-N 2.84Å; Q249-Y253 VanDerWaalsContact OE1-CE2 3.27Å; Q249-Y255 PolarHBondContact O-OH 3.16Å; Q249-Y255 VanDerWaalsContact O-OH 3.12Å
250	R	97.5	Very high	97.1	Very high	46 Å²	46	66.8 Å²	66.8	17%	0.174	32%	0.322	C	S	.	.	H	α-helix	trans	-68.1	-21.9	-179.1	-65	-176	174.2	-168.2	1.4	114.2	K247 K248 Y255 T317 Y318 E322	K247-R250 VanDerWaalsContact O-CB 3.3Å; K247-R250 WeakPolarHBondContact O-CB 3.43Å; K247-R250 PolarHBondContact O-N 3.19Å; K247-R250 VanDerWaalsContact O-N 3.15Å; K248-R250 PolarHBondContact O-N 2.88Å; R250-Y255 WeakPolarHBondContact O-CE2 3.48Å; R250-T317 WeakPolarHBondContact O-CB 3.41Å; R250-Y318 WeakPolarHBondContact CB-O 3.39Å; R250-Y318 HydrophobicContact CG-CD1 3.96Å; R250-Y318 HydrophobicContact CG-CG 4.49Å; R250-Y318 PolarHBondContact O-N 2.97Å; R250-E322 IonicContact CZ-OE2 3.53Å; R250-E322 VanDerWaalsContact NH1-CD 3.35Å; R250-E322 IonicContact NH1-OE1 3.53Å; R250-E322 IonicContact NH1-OE2 3.65Å; R250-E322 PolarHBondContact NH1-OE2 3.38Å; R250-E322 IonicContact NH2-OE2 2.71Å
251	F	98.1	Very high	96.5	Very high	13 Å²	13	70 Å²	70	6%	0.057	34%	0.344	C	S	.	.	H	α-helix	trans	-129.1	-1.4	-177	57.3	-108.4	0	0	0	113.9	P243 K248 Q249 M284 I286 W313 T317	P243-F251 HydrophobicContact CB-CE1 4.22Å; P243-F251 HydrophobicContact CB-CZ 3.98Å; P243-F251 HydrophobicContact CG-CZ 4.1Å; K248-F251 HydrophobicContact CB-CE2 4.31Å; K248-F251 HydrophobicContact CB-CZ 4.1Å; K248-F251 HydrophobicContact CG-CE2 4.35Å; K248-F251 HydrophobicContact CG-CZ 3.91Å; K248-F251 PolarHBondContact O-N 2.76Å; K248-F251 VanDerWaalsContact O-N 3.09Å; Q249-F251 VanDerWaalsContact C-N 3.26Å; Q249-F251 PolarHBondContact O-N 2.84Å; F251-M284 HydrophobicContact CB-CE 4.44Å; F251-M284 HydrophobicContact CD1-CE 4.05Å; F251-M284 HydrophobicContact CD2-CE 4.29Å; F251-M284 HydrophobicContact CD2-CG 4.14Å; F251-M284 HydrophobicContact CE1-CB 4.4Å; F251-M284 HydrophobicContact CE1-CE 4.34Å; F251-M284 HydrophobicContact CE2-CB 3.93Å; F251-M284 HydrophobicContact CE2-CG 3.81Å; F251-M284 HydrophobicContact CG-CE 4.02Å; F251-M284 HydrophobicContact CZ-CB 3.77Å; F251-M284 HydrophobicContact CZ-CG 4.15Å; F251-I286 HydrophobicContact CE1-CG2 4.23Å; F251-W313 HydrophobicContact CB-CH2 3.87Å; F251-W313 HydrophobicContact CB-CZ3 4.39Å; F251-W313 HydrophobicContact CD2-CH2 4.28Å; F251-W313 HydrophobicContact CG-CH2 4.41Å; F251-T317 HydrophobicContact CB-CG2 3.92Å
252	L	97.9	Very high	95.4	Very high	77 Å²	77	79 Å²	79	40%	0.403	38%	0.381	S	S	.	.	H	α-helix	trans	-79.1	-18.9	171.8	-74.3	174.7	0	0	0	113.5	K248 K275	K248-L252 HydrophobicContact CB-CD1 3.9Å; K248-L252 HydrophobicContact CB-CG 4.38Å; K248-L252 VanDerWaalsContact O-CG 3.29Å; K248-L252 WeakPolarHBondContact O-CG 3.38Å; K248-L252 PolarHBondContact O-N 2.83Å; K248-L252 VanDerWaalsContact O-N 3.09Å; L252-K275 PolarHBondContact O-N 3.49Å
253	Y	97.9	Very high	94.5	Very high	73 Å²	73	80.4 Å²	80.4	29%	0.286	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.5	-177.3	-64.6	-94.3	0	0	0	110.5	Q249 Y255 K270 Q273 A274 K275	Q249-Y253 VanDerWaalsContact OE1-CE2 3.27Å; Y253-Y255 WeakPolarHBondContact O-CD2 2.99Å; Y253-Y255 WeakPolarHBondContact O-CE2 3.5Å; Y253-K270 VanDerWaalsContact CD2-NZ 3.28Å; Y253-K270 VanDerWaalsContact CE2-NZ 3.28Å; Y253-K270 HydrophobicContact CG-CD 4.46Å; Y253-K270 HydrophobicContact CG-CG 4.5Å; Y253-Q273 WeakPolarHBondContact CA-O 3.5Å; Y253-A274 HydrophobicContact CE1-CB 4.49Å; Y253-K275 WeakPolarHBondContact O-CD 3.19Å
254	R	98.1	Very high	93.7	Very high	86 Å²	86	81.7 Å²	81.7	33%	0.325	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	142	173.2	175.7	169	-170.7	-152.8	-5.8	110.7	E256 T271 Q273 K275 D316	R254-E256 IonicContact CZ-OE1 3.24Å; R254-E256 IonicContact NE-OE1 3.56Å; R254-E256 IonicContact NH1-OE1 3.74Å; R254-E256 IonicContact NH2-OE1 2.68Å; R254-E256 PolarHBondContact NH2-OE1 2.76Å; R254-T271 WeakPolarHBondContact CB-OG1 3.3Å; R254-T271 HydrophobicContact CG-CG2 4.49Å; R254-T271 WeakPolarHBondContact O-CB 3.49Å; R254-T271 WeakPolarHBondContact O-CG2 3.38Å; R254-T271 PolarHBondContact O-N 3.4Å; R254-T271 PolarHBondContact O-OG1 2.88Å; R254-Q273 HydrophobicContact CB-CB 4.25Å; R254-Q273 PolarHBondContact N-O 3.35Å; R254-Q273 VanDerWaalsContact NH1-OE1 3.14Å; R254-K275 HydrophobicContact CB-CG 4.41Å; R254-D316 CarbonylContact C-O 3.55Å; R254-D316 WeakPolarHBondContact CA-O 3.35Å; R254-D316 WeakPolarHBondContact CD-OD2 3.44Å; R254-D316 HydrophobicContact CG-CB 3.98Å; R254-D316 WeakPolarHBondContact CG-OD2 3.4Å; R254-D316 IonicContact NE-OD2 3.83Å; R254-D316 PolarHBondContact NE-OD2 3.48Å
255	Y	98.3	Very high	93.3	Very high	28 Å²	28	83.8 Å²	83.8	11%	0.11	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.5	175.9	-71.5	-104.3	0	0	0	110.1	Q249 R250 Y253 P268 V269 K270 D316 Y318	Q249-Y255 PolarHBondContact O-OH 3.16Å; Q249-Y255 VanDerWaalsContact O-OH 3.12Å; R250-Y255 WeakPolarHBondContact O-CE2 3.48Å; Y253-Y255 WeakPolarHBondContact O-CD2 2.99Å; Y253-Y255 WeakPolarHBondContact O-CE2 3.5Å; Y255-P268 HydrophobicContact CD1-CB 4.22Å; Y255-P268 HydrophobicContact CG-CB 4.44Å; Y255-V269 VanDerWaalsContact CA-O 3.31Å; Y255-V269 WeakPolarHBondContact CA-O 3.34Å; Y255-K270 VanDerWaalsContact CD1-CA 3.48Å; Y255-K270 HydrophobicContact CD1-CB 3.99Å; Y255-K270 VanDerWaalsContact CD1-N 3.31Å; Y255-K270 HydrophobicContact CE1-CB 3.45Å; Y255-K270 VanDerWaalsContact CE1-CB 3.45Å; Y255-K270 HydrophobicContact CE1-CG 4.08Å; Y255-K270 HydrophobicContact CE2-CG 4.34Å; Y255-D316 PolarHBondContact N-O 2.91Å; Y255-Y318 AromaticContact CD1-CD2 3.69Å; Y255-Y318 HydrophobicContact CD1-CD2 3.69Å; Y255-Y318 HydrophobicContact CD1-CG 4.18Å; Y255-Y318 AromaticContact CE1-CD2 3.61Å; Y255-Y318 HydrophobicContact CE1-CD2 3.61Å; Y255-Y318 AromaticContact CE1-CG 3.91Å; Y255-Y318 HydrophobicContact CE1-CG 3.91Å
256	E	97.3	Very high	93.2	Very high	82 Å²	82	81.4 Å²	81.4	38%	0.383	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	138.9	178.7	-68.4	-178.2	170.1	0	0	110.1	R254 Q258 P268 V269 T271	R254-E256 IonicContact CZ-OE1 3.24Å; R254-E256 IonicContact NE-OE1 3.56Å; R254-E256 IonicContact NH1-OE1 3.74Å; R254-E256 IonicContact NH2-OE1 2.68Å; R254-E256 PolarHBondContact NH2-OE1 2.76Å; E256-Q258 PolarHBondContact O-N 2.03Å; E256-P268 WeakPolarHBondContact O-CA 3.41Å; E256-V269 PolarHBondContact N-O 3.11Å; E256-V269 PolarHBondContact O-N 2.89Å; E256-T271 HydrophobicContact CB-CG2 4.27Å; E256-T271 HydrophobicContact CG-CG2 3.8Å
257	L	96.6	Very high	93.2	Very high	77 Å²	77	77.1 Å²	77.1	40%	0.403	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	117.9	177.5	-78.2	177.3	0	0	0	110.2	F182 K266 P268	F182-L257 HydrophobicContact CB-CD2 4.12Å; F182-L257 HydrophobicContact CD2-CD1 3.85Å; F182-L257 HydrophobicContact CE2-CD1 4.43Å; F182-L257 HydrophobicContact CG-CD1 4.42Å; L257-K266 HydrophobicContact CD2-CB 4.29Å; L257-P268 HydrophobicContact CD2-CB 4.47Å; L257-P268 HydrophobicContact CD2-CG 4.03Å
258	Q	96.5	Very high	93.2	Very high	96 Å²	96	75.5 Å²	75.5	45%	0.449	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	158	173.7	-59.7	-175	12.8	0	0	110.3	E256 K266 L267 V269	E256-Q258 PolarHBondContact O-N 2.03Å; Q258-K266 CarbonylContact O-C 3.49Å; Q258-K266 WeakPolarHBondContact O-CA 3.34Å; Q258-K266 WeakPolarHBondContact O-CB 3.43Å; Q258-L267 PolarHBondContact N-O 3.06Å; Q258-L267 PolarHBondContact O-N 3.33Å; Q258-V269 HydrophobicContact CB-CG2 3.88Å; Q258-V269 HydrophobicContact CG-CB 4.13Å; Q258-V269 HydrophobicContact CG-CG2 3.97Å
259	D	95.1	Very high	93.2	Very high	137 Å²	137	75.1 Å²	75.1	73%	0.733	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	142.1	176.6	-65.8	-29.3	0	0	0	110.8	K266	D259-K266 VanDerWaalsContact OD1-CE 3.24Å; D259-K266 WeakPolarHBondContact OD1-CE 3.39Å; D259-K266 IonicContact OD1-NZ 2.76Å
260	A	91.8	Very high	93.2	Very high	37 Å²	37	76.2 Å²	76.2	31%	0.306	37%	0.366	S	S	.	.			trans	-133.7	-172.3	-174.2	0	0	0	0	0	110.8	K265 L267	A260-K265 PolarHBondContact N-O 2.68Å; A260-L267 HydrophobicContact CB-CB 4.13Å; A260-L267 HydrophobicContact CB-CD1 3.85Å; A260-L267 HydrophobicContact CB-CG 3.72Å
261	S	85.2	Confident	93.2	Very high	68 Å²	68	75.3 Å²	75.3	48%	0.476	37%	0.366	S	S	.	.			trans	-57.6	163	176.8	69.6	0	0	0	0	112.5	E263 Y264 K265	S261-E263 PolarHBondContact O-N 2.87Å; S261-E263 VanDerWaalsContact O-N 3.09Å; S261-Y264 PolarHBondContact O-N 2.78Å; S261-K265 PolarHBondContact O-N 3.24Å
262	F	77.1	Confident	93.1	Very high	202 Å²	202	84.2 Å²	84.2	89%	0.886	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-37.3	-179.7	-179.6	-97.4	0	0	0	113.5
263	E	79.3	Confident	93.1	Very high	140 Å²	140	85.7 Å²	85.7	65%	0.654	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-47.2	178.9	-174.1	-176.7	176.2	0	0	112.3	S261	S261-E263 PolarHBondContact O-N 2.87Å; S261-E263 VanDerWaalsContact O-N 3.09Å
264	Y	81.1	Confident	93.1	Very high	51 Å²	51	85.5 Å²	85.5	20%	0.2	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-25	-173.4	-69.2	-74.6	0	0	0	113.2	Y183 S261 K266 L267 R374	Y183-Y264 HydrophobicContact CD1-CD1 4.12Å; Y183-Y264 AromaticContact CD1-CE1 3.9Å; Y183-Y264 HydrophobicContact CD1-CE1 3.9Å; Y183-Y264 HydrophobicContact CD2-CE1 4.28Å; Y183-Y264 HydrophobicContact CE1-CE1 4.43Å; Y183-Y264 AromaticContact CG-CD1 3.97Å; Y183-Y264 HydrophobicContact CG-CD1 3.97Å; Y183-Y264 AromaticContact CG-CE1 3.79Å; Y183-Y264 HydrophobicContact CG-CE1 3.79Å; S261-Y264 PolarHBondContact O-N 2.78Å; Y264-K266 PolarHBondContact O-N 2.84Å; Y264-L267 HydrophobicContact CD1-CD2 3.83Å; Y264-L267 HydrophobicContact CD2-CD1 4.38Å; Y264-L267 HydrophobicContact CG-CD1 4.2Å; Y264-L267 HydrophobicContact CG-CD2 3.93Å; Y264-L267 HydrophobicContact CG-CG 4.2Å; Y264-R374 WeakPolarHBondContact OH-CD 3.27Å
265	K	88.4	Confident	93.1	Very high	105 Å²	105	83.2 Å²	83.2	46%	0.457	42%	0.418	S	S	.	.	S	Bend	trans	59.5	-53.4	-170.5	-57.1	-173	179	-175.5	0	113.7	K153 F182 A260 S261	K153-K265 HydrophobicContact CD-CD 4.06Å; F182-K265 HydrophobicContact CE1-CB 4.39Å; A260-K265 PolarHBondContact N-O 2.68Å; S261-K265 PolarHBondContact O-N 3.24Å
266	K	94.9	Very high	93.1	Very high	77 Å²	77	85.7 Å²	85.7	34%	0.335	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	149.5	173.1	-57.8	-168.2	175.1	-157.7	0	111.9	F182 L257 Q258 D259 Y264	F182-K266 HydrophobicContact CD1-CB 3.67Å; F182-K266 HydrophobicContact CD1-CG 4.17Å; F182-K266 HydrophobicContact CE1-CB 3.93Å; F182-K266 HydrophobicContact CE1-CD 4.12Å; F182-K266 HydrophobicContact CE1-CG 3.88Å; F182-K266 HydrophobicContact CG-CB 4.16Å; F182-K266 HydrophobicContact CZ-CD 4.09Å; F182-K266 HydrophobicContact CZ-CG 4.37Å; L257-K266 HydrophobicContact CD2-CB 4.29Å; Q258-K266 CarbonylContact O-C 3.49Å; Q258-K266 WeakPolarHBondContact O-CA 3.34Å; Q258-K266 WeakPolarHBondContact O-CB 3.43Å; D259-K266 VanDerWaalsContact OD1-CE 3.24Å; D259-K266 WeakPolarHBondContact OD1-CE 3.39Å; D259-K266 IonicContact OD1-NZ 2.76Å; Y264-K266 PolarHBondContact O-N 2.84Å
267	L	95.3	Very high	93.1	Very high	48 Å²	48	86.9 Å²	86.9	25%	0.251	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.3	175.1	-72.5	174.5	0	0	0	111.1	Y183 Q258 A260 Y264 V269	Y183-L267 HydrophobicContact CD1-CD2 3.62Å; Y183-L267 HydrophobicContact CG-CD2 4.34Å; Q258-L267 PolarHBondContact N-O 3.06Å; Q258-L267 PolarHBondContact O-N 3.33Å; A260-L267 HydrophobicContact CB-CB 4.13Å; A260-L267 HydrophobicContact CB-CD1 3.85Å; A260-L267 HydrophobicContact CB-CG 3.72Å; Y264-L267 HydrophobicContact CD1-CD2 3.83Å; Y264-L267 HydrophobicContact CD2-CD1 4.38Å; Y264-L267 HydrophobicContact CG-CD1 4.2Å; Y264-L267 HydrophobicContact CG-CD2 3.93Å; Y264-L267 HydrophobicContact CG-CG 4.2Å; L267-V269 PolarHBondContact O-N 3.38Å
268	P	96.8	Very high	93.2	Very high	12 Å²	12	84.4 Å²	84.4	8%	0.078	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	121	169.9	-7.6	20.4	0	0	0	109.8	Y183 A184 Y255 E256 L257 Y318	Y183-P268 VanDerWaalsContact O-CD 3.24Å; Y183-P268 WeakPolarHBondContact O-CD 3.28Å; A184-P268 HydrophobicContact CB-CG 4.19Å; A184-P268 WeakPolarHBondContact O-CG 3.45Å; Y255-P268 HydrophobicContact CD1-CB 4.22Å; Y255-P268 HydrophobicContact CG-CB 4.44Å; E256-P268 WeakPolarHBondContact O-CA 3.41Å; L257-P268 HydrophobicContact CD2-CB 4.47Å; L257-P268 HydrophobicContact CD2-CG 4.03Å; P268-Y318 HydrophobicContact CB-CD2 4.05Å; P268-Y318 HydrophobicContact CG-CD2 4.29Å
269	V	97.1	Very high	93.2	Very high	58 Å²	58	81.4 Å²	81.4	35%	0.352	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.5	177.8	179.2	0	0	0	0	109.1	Y255 E256 Q258 L267 T271	Y255-V269 VanDerWaalsContact CA-O 3.31Å; Y255-V269 WeakPolarHBondContact CA-O 3.34Å; E256-V269 PolarHBondContact N-O 3.11Å; E256-V269 PolarHBondContact O-N 2.89Å; Q258-V269 HydrophobicContact CB-CG2 3.88Å; Q258-V269 HydrophobicContact CG-CB 4.13Å; Q258-V269 HydrophobicContact CG-CG2 3.97Å; L267-V269 PolarHBondContact O-N 3.38Å; V269-T271 PolarHBondContact O-N 3.16Å
270	K	97.4	Very high	93.3	Very high	87 Å²	87	79.8 Å²	79.8	38%	0.378	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	128.5	179.3	-173.4	178.8	176.2	177.3	0	110	Y253 Y255	Y253-K270 VanDerWaalsContact CD2-NZ 3.28Å; Y253-K270 VanDerWaalsContact CE2-NZ 3.28Å; Y253-K270 HydrophobicContact CG-CD 4.46Å; Y253-K270 HydrophobicContact CG-CG 4.5Å; Y255-K270 VanDerWaalsContact CD1-CA 3.48Å; Y255-K270 HydrophobicContact CD1-CB 3.99Å; Y255-K270 VanDerWaalsContact CD1-N 3.31Å; Y255-K270 HydrophobicContact CE1-CB 3.45Å; Y255-K270 VanDerWaalsContact CE1-CB 3.45Å; Y255-K270 HydrophobicContact CE1-CG 4.08Å; Y255-K270 HydrophobicContact CE2-CG 4.34Å
271	T	97.4	Very high	93.5	Very high	28 Å²	28	85.2 Å²	85.2	17%	0.172	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	173.1	171.8	73.3	0	0	0	0	111.2	R254 E256 V269 Q273	R254-T271 WeakPolarHBondContact CB-OG1 3.3Å; R254-T271 HydrophobicContact CG-CG2 4.49Å; R254-T271 WeakPolarHBondContact O-CB 3.49Å; R254-T271 WeakPolarHBondContact O-CG2 3.38Å; R254-T271 PolarHBondContact O-N 3.4Å; R254-T271 PolarHBondContact O-OG1 2.88Å; E256-T271 HydrophobicContact CB-CG2 4.27Å; E256-T271 HydrophobicContact CG-CG2 3.8Å; V269-T271 PolarHBondContact O-N 3.16Å; T271-Q273 PolarHBondContact OG1-N 3.11Å
272	Q	96.3	Very high	94.1	Very high	199 Å²	199	82.5 Å²	82.5	93%	0.93	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	-6.1	171.7	-62.5	-176.9	7.6	0	0	113	A274	Q272-A274 PolarHBondContact O-N 2.95Å
273	Q	97.7	Very high	95.1	Very high	109 Å²	109	76.9 Å²	76.9	51%	0.509	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	114.7	-177.5	-174.3	177	12.9	0	0	110.3	Y253 R254 T271	Y253-Q273 WeakPolarHBondContact CA-O 3.5Å; R254-Q273 HydrophobicContact CB-CB 4.25Å; R254-Q273 PolarHBondContact N-O 3.35Å; R254-Q273 VanDerWaalsContact NH1-OE1 3.14Å; T271-Q273 PolarHBondContact OG1-N 3.11Å
274	A	97.9	Very high	96	Very high	68 Å²	68	71 Å²	71	56%	0.562	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	142.3	169.6	0	0	0	0	0	110.5	Y253 Q272	Y253-A274 HydrophobicContact CE1-CB 4.49Å; Q272-A274 PolarHBondContact O-N 2.95Å
275	K	97.8	Very high	96.9	Very high	38 Å²	38	68.6 Å²	68.6	17%	0.165	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-83.5	151.2	174.1	-71.2	179.5	60.4	67.1	0	110.4	L252 Y253 R254 W313 D316 T317	L252-K275 PolarHBondContact O-N 3.49Å; Y253-K275 WeakPolarHBondContact O-CD 3.19Å; R254-K275 HydrophobicContact CB-CG 4.41Å; K275-W313 VanDerWaalsContact CE-CE2 3.45Å; K275-W313 VanDerWaalsContact CE-O 3.29Å; K275-W313 WeakPolarHBondContact CE-O 3.1Å; K275-W313 PolarHBondContact NZ-O 3.04Å; K275-D316 IonicContact NZ-OD1 3.11Å; K275-D316 PolarHBondContact NZ-OD1 2.68Å; K275-D316 IonicContact NZ-OD2 3.52Å; K275-T317 HydrophobicContact CD-CG2 3.9Å
276	S	97.5	Very high	97.4	Very high	81 Å²	81	64.5 Å²	64.5	57%	0.566	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-60.9	157.9	163.2	63.9	0	0	0	0	109.9	W313	S276-W313 PolarHBondContact O-NE1 3.4Å
277	P	97.8	Very high	97.5	Very high	107 Å²	107	61 Å²	61	70%	0.695	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-51.5	153.2	167.7	-25.3	34.9	0	0	0	111.6	W313	P277-W313 PolarHBondContact O-NE1 3.21Å
278	P	97.8	Very high	97.6	Very high	25 Å²	25	59.9 Å²	59.9	16%	0.162	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-51.5	141.6	171.1	-23.4	31.7	0	0	0	110.9	I282 M284 F310 W313	P278-I282 HydrophobicContact CB-CB 3.9Å; P278-I282 HydrophobicContact CB-CG2 4.31Å; P278-M284 HydrophobicContact CB-SD 4.21Å; P278-M284 HydrophobicContact CG-CG 3.62Å; P278-M284 HydrophobicContact CG-SD 3.58Å; P278-M284 VanDerWaalsContact CG-SD 3.58Å; P278-F310 HydrophobicContact CB-CD2 4.48Å; P278-F310 HydrophobicContact CB-CE2 4.35Å; P278-W313 HydrophobicContact CB-CH2 4.47Å; P278-W313 HydrophobicContact CB-CZ2 4.4Å; P278-W313 HydrophobicContact CG-CH2 3.79Å; P278-W313 HydrophobicContact CG-CZ2 3.81Å; P278-W313 HydrophobicContact CG-CZ3 4.27Å
279	P	97.9	Very high	97.6	Very high	33 Å²	33	59.8 Å²	59.8	21%	0.214	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-63.1	162.9	-180	28.9	-35.8	0	0	0	110.9	N281 I282 D309 F310 W313	P279-N281 PolarHBondContact O-N 3.39Å; P279-N281 VanDerWaalsContact O-N 3.1Å; P279-I282 WeakPolarHBondContact O-CB 3.35Å; P279-I282 WeakPolarHBondContact O-CD1 3.21Å; P279-I282 WeakPolarHBondContact O-CG1 3.47Å; P279-I282 PolarHBondContact O-N 2.84Å; P279-I282 VanDerWaalsContact O-N 3.12Å; P279-D309 HydrophobicContact CB-CB 4.38Å; P279-D309 HydrophobicContact CG-CB 4.12Å; P279-F310 HydrophobicContact CG-CB 4.5Å; P279-W313 HydrophobicContact CG-CB 4.25Å
280	H	97.4	Very high	97.7	Very high	102 Å²	102	58.7 Å²	58.7	47%	0.472	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	58.1	25.5	174	-51.9	-66.6	0	0	0	115	I282 V306 D309	H280-I282 HydrophobicContact CB-CG1 4.34Å; H280-I282 PolarHBondContact O-N 2.88Å; H280-V306 HydrophobicContact CB-CG1 4.05Å; H280-D309 IonicContact CD2-OD2 3.54Å; H280-D309 IonicContact CE1-OD2 2.71Å; H280-D309 IonicContact NE2-OD2 3.47Å; H280-D309 PolarHBondContact NE2-OD2 2.98Å
281	N	95.8	Very high	97.8	Very high	152 Å²	152	54.6 Å²	54.6	81%	0.813	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	52.9	37.2	-175.5	-59.2	-36.5	0	0	0	112.6	P279 E283	P279-N281 PolarHBondContact O-N 3.39Å; P279-N281 VanDerWaalsContact O-N 3.1Å; N281-E283 PolarHBondContact O-N 3.37Å
282	I	97.9	Very high	97.8	Very high	10 Å²	10	53.3 Å²	53.3	5%	0.051	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-64.9	127.8	175.5	-70.8	169.2	0	0	0	109.1	P278 P279 H280 V306 F310 T327 L331	P278-I282 HydrophobicContact CB-CB 3.9Å; P278-I282 HydrophobicContact CB-CG2 4.31Å; P279-I282 WeakPolarHBondContact O-CB 3.35Å; P279-I282 WeakPolarHBondContact O-CD1 3.21Å; P279-I282 WeakPolarHBondContact O-CG1 3.47Å; P279-I282 PolarHBondContact O-N 2.84Å; P279-I282 VanDerWaalsContact O-N 3.12Å; H280-I282 HydrophobicContact CB-CG1 4.34Å; H280-I282 PolarHBondContact O-N 2.88Å; I282-V306 HydrophobicContact CD1-CG1 3.98Å; I282-F310 HydrophobicContact CD1-CB 3.68Å; I282-F310 HydrophobicContact CD1-CD2 3.8Å; I282-F310 HydrophobicContact CD1-CG 3.78Å; I282-F310 HydrophobicContact CG2-CD2 4.22Å; I282-F310 HydrophobicContact CG2-CE2 4.03Å; I282-F310 HydrophobicContact CG2-CZ 4.41Å; I282-T327 HydrophobicContact CG2-CG2 3.32Å; I282-L331 HydrophobicContact CD1-CD1 4.41Å; I282-L331 HydrophobicContact CG1-CD1 3.94Å
283	E	98.1	Very high	97.9	Very high	85 Å²	85	43.9 Å²	43.9	40%	0.397	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-86.7	128.2	172.4	-174.7	176.5	173.5	0	0	109.3	N281 F285 T327 R340	N281-E283 PolarHBondContact O-N 3.37Å; E283-F285 HydrophobicContact CB-CE2 4.15Å; E283-F285 HydrophobicContact CG-CE2 3.94Å; E283-F285 HydrophobicContact CG-CZ 4.26Å; E283-F285 WeakPolarHBondContact O-CD2 3.34Å; E283-T327 WeakPolarHBondContact O-CG2 3.32Å; E283-R340 WeakPolarHBondContact OE2-CD 3.31Å; E283-R340 IonicContact OE2-NH1 3.94Å
284	M	98.4	Very high	98	Very high	17 Å²	17	38.7 Å²	38.7	8%	0.084	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-81.1	134.7	-175	-67.4	-58.7	-65.8	0	0	112.2	P243 F251 P278 F310 W313 H323 T327	P243-M284 VanDerWaalsContact CD-O 3.26Å; P243-M284 WeakPolarHBondContact CD-O 3.28Å; F251-M284 HydrophobicContact CB-CE 4.44Å; F251-M284 HydrophobicContact CD1-CE 4.05Å; F251-M284 HydrophobicContact CD2-CE 4.29Å; F251-M284 HydrophobicContact CD2-CG 4.14Å; F251-M284 HydrophobicContact CE1-CB 4.4Å; F251-M284 HydrophobicContact CE1-CE 4.34Å; F251-M284 HydrophobicContact CE2-CB 3.93Å; F251-M284 HydrophobicContact CE2-CG 3.81Å; F251-M284 HydrophobicContact CG-CE 4.02Å; F251-M284 HydrophobicContact CZ-CB 3.77Å; F251-M284 HydrophobicContact CZ-CG 4.15Å; P278-M284 HydrophobicContact CB-SD 4.21Å; P278-M284 HydrophobicContact CG-CG 3.62Å; P278-M284 HydrophobicContact CG-SD 3.58Å; P278-M284 VanDerWaalsContact CG-SD 3.58Å; M284-F310 HydrophobicContact CE-CE2 4.21Å; M284-F310 HydrophobicContact CE-CZ 4.01Å; M284-F310 HydrophobicContact SD-CE2 3.6Å; M284-F310 VanDerWaalsContact SD-CE2 3.6Å; M284-F310 HydrophobicContact SD-CZ 3.8Å; M284-W313 HydrophobicContact CE-CH2 4.14Å; M284-W313 HydrophobicContact CE-CZ3 3.85Å; M284-W313 HydrophobicContact SD-CH2 4.07Å; M284-W313 HydrophobicContact SD-CZ3 3.91Å; M284-H323 HydrophobicContact CE-CB 4.13Å; M284-T327 HydrophobicContact SD-CG2 4.23Å
285	F	98.8	Very high	98	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.204	C	C	.	.			trans	-125.3	161	169.2	-65.8	-93.3	0	0	0	110.3	S241 R242 E283 H323 A326 T327 R330 R340	S241-F285 WeakPolarHBondContact O-CA 3.03Å; R242-F285 HydrophobicContact CG-CD1 4.32Å; R242-F285 HydrophobicContact CG-CE1 3.96Å; E283-F285 HydrophobicContact CB-CE2 4.15Å; E283-F285 HydrophobicContact CG-CE2 3.94Å; E283-F285 HydrophobicContact CG-CZ 4.26Å; E283-F285 WeakPolarHBondContact O-CD2 3.34Å; F285-H323 WeakPolarHBondContact O-CA 3.44Å; F285-H323 VanDerWaalsContact O-CB 3.3Å; F285-H323 WeakPolarHBondContact O-CB 3.31Å; F285-A326 HydrophobicContact CB-CB 4.26Å; F285-A326 WeakPolarHBondContact CB-O 3.43Å; F285-T327 PolarHBondContact N-OG1 2.89Å; F285-T327 PolarHBondContact O-OG1 3.46Å; F285-R330 VanDerWaalsContact CD1-CD 3.47Å; F285-R330 HydrophobicContact CD2-CB 3.86Å; F285-R330 HydrophobicContact CD2-CG 4.21Å; F285-R330 HydrophobicContact CE2-CB 3.75Å; F285-R330 HydrophobicContact CE2-CG 4.31Å; F285-R330 HydrophobicContact CG-CB 4.5Å; F285-R330 HydrophobicContact CG-CG 4.37Å; F285-R330 HydrophobicContact CZ-CB 4.31Å; F285-R330 VanDerWaalsContact CZ-CD 3.49Å; F285-R340 HydrophobicContact CE2-CG 4.17Å; F285-R340 HydrophobicContact CZ-CB 4.29Å; F285-R340 HydrophobicContact CZ-CG 4.2Å
286	I	98.5	Very high	97.9	Very high	19 Å²	19	40.3 Å²	40.3	10%	0.097	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-122.7	155.6	178.8	58.5	164.7	0	0	0	110.7	T240 S241 P243 K247 F251 E322 H323 A326	T240-I286 CarbonylContact C-O 3.58Å; T240-I286 WeakPolarHBondContact CA-O 3.37Å; S241-I286 PolarHBondContact N-O 2.77Å; S241-I286 WeakPolarHBondContact O-CG1 3.08Å; S241-I286 PolarHBondContact O-N 2.96Å; P243-I286 HydrophobicContact CB-CG1 4.4Å; P243-I286 HydrophobicContact CB-CG2 3.84Å; K247-I286 HydrophobicContact CB-CD1 3.89Å; K247-I286 HydrophobicContact CB-CG2 4.19Å; K247-I286 HydrophobicContact CD-CD1 3.94Å; K247-I286 HydrophobicContact CG-CD1 3.8Å; F251-I286 HydrophobicContact CE1-CG2 4.23Å; I286-E322 WeakPolarHBondContact CA-O 3.45Å; I286-H323 HydrophobicContact CG2-CB 4.29Å; I286-A326 WeakPolarHBondContact O-CB 3.37Å
287	G	97.8	Very high	98	Very high	2 Å²	2	36.5 Å²	36.5	2%	0.021	19%	0.19	C	C	.	.			trans	-165.3	-138.4	171.8	0	0	0	0	0	109.6	E322	G287-E322 PolarHBondContact N-O 2.87Å; G287-E322 WeakPolarHBondContact O-CB 3.39Å
288	N	97.1	Very high	98	Very high	25 Å²	25	31.6 Å²	31.6	13%	0.134	16%	0.158	C	C	.	.			trans	-121.9	178	174.4	68.7	60.4	0	0	0	111.3	E239 Y290	E239-N288 WeakPolarHBondContact OE2-CB 3.43Å; E239-N288 PolarHBondContact OE2-N 2.88Å; E239-N288 PolarHBondContact OE2-ND2 2.94Å; N288-Y290 PolarHBondContact O-N 3.43Å; N288-Y290 WeakPolarHBondContact OD1-CA 3.35Å; N288-Y290 WeakPolarHBondContact OD1-CB 3.39Å; N288-Y290 WeakPolarHBondContact OD1-CD2 3.48Å; N288-Y290 PolarHBondContact OD1-N 2.71Å; N288-Y290 PolarHBondContact OD1-O 3.12Å
289	A	98.1	Very high	98	Very high	10 Å²	10	34.6 Å²	34.6	8%	0.083	17%	0.17	C	C	.	.	S	Bend	trans	-75.5	-8.9	-176.3	0	0	0	0	0	114.3	N211 D321	N211-A289 PolarHBondContact ND2-O 3.12Å; A289-D321 WeakPolarHBondContact CA-O 3.19Å; A289-D321 HydrophobicContact CB-CB 3.94Å
290	Y	98.6	Very high	98	Very high	35 Å²	35	35.7 Å²	35.7	14%	0.137	17%	0.172	C	C	.	.			trans	-100.6	139.6	-170.6	-51.2	-65.8	0	0	0	112.2	N211 N288 R353	N211-Y290 VanDerWaalsContact OD1-CA 3.25Å; N211-Y290 WeakPolarHBondContact OD1-CA 3.31Å; N288-Y290 PolarHBondContact O-N 3.43Å; N288-Y290 WeakPolarHBondContact OD1-CA 3.35Å; N288-Y290 WeakPolarHBondContact OD1-CB 3.39Å; N288-Y290 WeakPolarHBondContact OD1-CD2 3.48Å; N288-Y290 PolarHBondContact OD1-N 2.71Å; N288-Y290 PolarHBondContact OD1-O 3.12Å; Y290-R353 HydrophobicContact CD2-CB 3.84Å; Y290-R353 HydrophobicContact CD2-CG 3.79Å; Y290-R353 HydrophobicContact CE2-CG 4.02Å; Y290-R353 HydrophobicContact CG-CB 4.22Å; Y290-R353 HydrophobicContact CG-CG 4.34Å
291	F	98.6	Very high	97.9	Very high	1 Å²	1	31.8 Å²	31.8	0%	0.004	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	159	-174.8	56.2	-107	0	0	0	112.5	D192 L196 V209 N211 L238 L293 W325	D192-F291 HydrophobicContact CB-CZ 4.43Å; L196-F291 HydrophobicContact CD1-CZ 4.01Å; L196-F291 HydrophobicContact CD2-CE2 4.38Å; L196-F291 HydrophobicContact CD2-CZ 4.46Å; V209-F291 HydrophobicContact CG1-CE2 4.25Å; N211-F291 HydrophobicContact CB-CD2 4.41Å; N211-F291 HydrophobicContact CB-CE1 3.95Å; N211-F291 HydrophobicContact CB-CE2 3.79Å; N211-F291 HydrophobicContact CB-CZ 3.54Å; N211-F291 VanDerWaalsContact CG-CE1 3.45Å; N211-F291 PolarHBondContact N-O 3.16Å; N211-F291 VanDerWaalsContact ND2-CE1 3.31Å; N211-F291 WeakPolarHBondContact ND2-CE1 3.45Å; N211-F291 PolarHBondContact OD1-N 3.2Å; N211-F291 PolarHBondContact OD1-O 2.93Å; L238-F291 HydrophobicContact CB-CB 4.15Å; F291-L293 HydrophobicContact CB-CD1 4.16Å; F291-L293 HydrophobicContact CB-CD2 4.22Å; F291-L293 HydrophobicContact CB-CG 3.9Å; F291-L293 HydrophobicContact CD1-CD1 4.25Å; F291-L293 HydrophobicContact CD2-CB 4.32Å; F291-L293 HydrophobicContact CD2-CD1 3.45Å; F291-L293 VanDerWaalsContact CD2-CD1 3.45Å; F291-L293 HydrophobicContact CD2-CG 3.53Å; F291-L293 HydrophobicContact CE2-CD1 3.81Å; F291-L293 HydrophobicContact CE2-CG 4.27Å; F291-L293 HydrophobicContact CG-CD1 3.69Å; F291-L293 HydrophobicContact CG-CG 3.86Å; F291-L293 HydrophobicContact CZ-CD1 4.35Å; F291-W325 AromaticContact CD1-CD1 3.89Å; F291-W325 AromaticContact CD1-CD2 3.78Å; F291-W325 HydrophobicContact CD1-CD2 3.78Å; F291-W325 AromaticContact CD1-CE2 3.72Å; F291-W325 HydrophobicContact CD1-CE3 4.34Å; F291-W325 AromaticContact CD1-CG 3.91Å; F291-W325 HydrophobicContact CD1-CG 3.91Å; F291-W325 HydrophobicContact CD1-CZ2 4.24Å; F291-W325 AromaticContact CD1-NE1 3.77Å; F291-W325 AromaticContact CE1-CD2 3.87Å; F291-W325 HydrophobicContact CE1-CD2 3.87Å; F291-W325 AromaticContact CE1-CE2 3.37Å; F291-W325 HydrophobicContact CE1-CE3 4.34Å; F291-W325 HydrophobicContact CE1-CG 4.39Å; F291-W325 AromaticContact CE1-CH2 4Å; F291-W325 HydrophobicContact CE1-CH2 4Å; F291-W325 AromaticContact CE1-CZ2 3.45Å; F291-W325 HydrophobicContact CE1-CZ2 3.45Å; F291-W325 VanDerWaalsContact CE1-CZ2 3.45Å; F291-W325 HydrophobicContact CE1-CZ3 4.38Å; F291-W325 AromaticContact CE1-NE1 3.64Å; F291-W325 HydrophobicContact CZ-CH2 4.29Å; F291-W325 HydrophobicContact CZ-CZ2 4.09Å
292	V	98.6	Very high	97.9	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	115.6	157.5	177.3	0	0	0	0	108.1	Y208 V209 I210 L229 L232 M237 T352 W393	Y208-V292 HydrophobicContact CD1-CG1 3.67Å; Y208-V292 HydrophobicContact CE1-CG1 4.49Å; Y208-V292 HydrophobicContact CG-CG1 4.16Å; V209-V292 WeakPolarHBondContact O-CA 3.38Å; I210-V292 HydrophobicContact CB-CG2 4.37Å; I210-V292 HydrophobicContact CD1-CG2 4.21Å; I210-V292 HydrophobicContact CG1-CG1 4.29Å; I210-V292 HydrophobicContact CG1-CG2 3.87Å; I210-V292 HydrophobicContact CG2-CG2 4.08Å; L229-V292 HydrophobicContact CD2-CG1 3.63Å; L232-V292 HydrophobicContact CD1-CG1 4.49Å; M237-V292 HydrophobicContact CB-CB 4.38Å; M237-V292 PolarHBondContact N-O 2.84Å; M237-V292 PolarHBondContact O-N 3.44Å; V292-T352 HydrophobicContact CB-CG2 4.33Å; V292-T352 HydrophobicContact CG2-CG2 3.96Å; V292-W393 HydrophobicContact CB-CZ3 3.91Å; V292-W393 HydrophobicContact CG1-CZ3 4.26Å; V292-W393 HydrophobicContact CG2-CE3 3.78Å; V292-W393 HydrophobicContact CG2-CZ3 3.59Å
293	L	98.6	Very high	97.8	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.6	-172.4	-59.1	172.4	0	0	0	109.9	Y208 V209 L238 F291 F297 I298 W325	Y208-L293 CarbonylContact C-O 3.57Å; Y208-L293 VanDerWaalsContact CA-O 3.28Å; Y208-L293 WeakPolarHBondContact CA-O 3.43Å; Y208-L293 VanDerWaalsContact CD1-C 3.46Å; Y208-L293 WeakPolarHBondContact CD1-O 3.43Å; V209-L293 HydrophobicContact CG1-CB 4.07Å; V209-L293 PolarHBondContact N-O 3.18Å; V209-L293 PolarHBondContact O-N 3.26Å; L238-L293 HydrophobicContact CD2-CD2 3.89Å; F291-L293 HydrophobicContact CB-CD1 4.16Å; F291-L293 HydrophobicContact CB-CD2 4.22Å; F291-L293 HydrophobicContact CB-CG 3.9Å; F291-L293 HydrophobicContact CD1-CD1 4.25Å; F291-L293 HydrophobicContact CD2-CB 4.32Å; F291-L293 HydrophobicContact CD2-CD1 3.45Å; F291-L293 VanDerWaalsContact CD2-CD1 3.45Å; F291-L293 HydrophobicContact CD2-CG 3.53Å; F291-L293 HydrophobicContact CE2-CD1 3.81Å; F291-L293 HydrophobicContact CE2-CG 4.27Å; F291-L293 HydrophobicContact CG-CD1 3.69Å; F291-L293 HydrophobicContact CG-CG 3.86Å; F291-L293 HydrophobicContact CZ-CD1 4.35Å; L293-F297 HydrophobicContact CB-CB 4.5Å; L293-F297 HydrophobicContact CB-CD1 4Å; L293-F297 HydrophobicContact CB-CG 4.41Å; L293-F297 HydrophobicContact CD1-CD1 3.78Å; L293-F297 HydrophobicContact CD1-CE1 3.64Å; L293-F297 HydrophobicContact CD2-CD1 3.92Å; L293-F297 HydrophobicContact CD2-CE1 3.81Å; L293-F297 HydrophobicContact CD2-CG 4.3Å; L293-F297 HydrophobicContact CD2-CZ 4.14Å; L293-F297 HydrophobicContact CG-CD1 4.09Å; L293-F297 HydrophobicContact CG-CE1 4.2Å; L293-I298 HydrophobicContact CB-CD1 3.94Å; L293-I298 HydrophobicContact CB-CG1 4.43Å; L293-I298 HydrophobicContact CD1-CD1 3.71Å; L293-I298 HydrophobicContact CG-CD1 4.48Å; L293-W325 HydrophobicContact CD1-CE3 4.07Å; L293-W325 HydrophobicContact CD1-CZ3 4.11Å
294	S	98.3	Very high	97.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	156.2	175.2	62.4	0	0	0	0	111.1	G234 E296 F297 I298	G234-S294 PolarHBondContact O-OG 2.83Å; S294-E296 PolarHBondContact O-N 2.62Å; S294-F297 WeakPolarHBondContact O-CB 3.3Å; S294-F297 PolarHBondContact O-N 2.93Å; S294-F297 VanDerWaalsContact O-N 3.16Å; S294-F297 WeakPolarHBondContact OG-CB 3.37Å; S294-F297 PolarHBondContact OG-N 2.86Å; S294-I298 PolarHBondContact O-N 3.41Å
295	R	97.8	Very high	97.7	Very high	47 Å²	47	32.6 Å²	32.6	18%	0.177	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-37.9	176	-174.2	164.2	-177.9	-142.7	10.1	112	L200 W206 K207 F297 I298 Q299	L200-R295 HydrophobicContact CD2-CG 4.2Å; W206-R295 HydrophobicContact CD2-CB 4.41Å; W206-R295 HydrophobicContact CD2-CG 4.26Å; W206-R295 HydrophobicContact CE3-CB 3.69Å; W206-R295 HydrophobicContact CE3-CG 3.99Å; W206-R295 HydrophobicContact CH2-CB 3.88Å; W206-R295 HydrophobicContact CH2-CG 3.68Å; W206-R295 HydrophobicContact CZ2-CG 3.96Å; W206-R295 HydrophobicContact CZ3-CB 3.4Å; W206-R295 HydrophobicContact CZ3-CG 3.71Å; W206-R295 WeakPolarHBondContact O-CD 3.44Å; K207-R295 PolarHBondContact O-N 3.18Å; R295-F297 VanDerWaalsContact C-N 3.32Å; R295-F297 PolarHBondContact O-N 2.85Å; R295-I298 PolarHBondContact O-N 2.71Å; R295-Q299 HydrophobicContact CG-CG 4.47Å; R295-Q299 WeakPolarHBondContact O-CG 3.28Å; R295-Q299 PolarHBondContact O-N 2.74Å
296	E	97.7	Very high	97.7	Very high	93 Å²	93	34.7 Å²	34.7	44%	0.435	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-38.8	177.4	-64.3	72.4	-160.2	0	0	111.4	S294 I298 Q299 F300 P335	S294-E296 PolarHBondContact O-N 2.62Å; E296-I298 PolarHBondContact O-N 3.22Å; E296-Q299 PolarHBondContact O-N 3.43Å; E296-F300 WeakPolarHBondContact O-CB 3.27Å; E296-F300 PolarHBondContact O-N 3.34Å; E296-P335 HydrophobicContact CB-CB 3.8Å; E296-P335 HydrophobicContact CB-CG 4.23Å
297	F	98.3	Very high	97.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.2	-46.6	173.6	-176.7	-84	0	0	0	111.1	L293 S294 R295 F300 M301 L328 V329 V334 P335	L293-F297 HydrophobicContact CB-CB 4.5Å; L293-F297 HydrophobicContact CB-CD1 4Å; L293-F297 HydrophobicContact CB-CG 4.41Å; L293-F297 HydrophobicContact CD1-CD1 3.78Å; L293-F297 HydrophobicContact CD1-CE1 3.64Å; L293-F297 HydrophobicContact CD2-CD1 3.92Å; L293-F297 HydrophobicContact CD2-CE1 3.81Å; L293-F297 HydrophobicContact CD2-CG 4.3Å; L293-F297 HydrophobicContact CD2-CZ 4.14Å; L293-F297 HydrophobicContact CG-CD1 4.09Å; L293-F297 HydrophobicContact CG-CE1 4.2Å; S294-F297 WeakPolarHBondContact O-CB 3.3Å; S294-F297 PolarHBondContact O-N 2.93Å; S294-F297 VanDerWaalsContact O-N 3.16Å; S294-F297 WeakPolarHBondContact OG-CB 3.37Å; S294-F297 PolarHBondContact OG-N 2.86Å; R295-F297 VanDerWaalsContact C-N 3.32Å; R295-F297 PolarHBondContact O-N 2.85Å; F297-F300 PolarHBondContact O-N 3.26Å; F297-M301 HydrophobicContact CD1-CG 4.08Å; F297-M301 HydrophobicContact CD1-SD 3.72Å; F297-M301 HydrophobicContact CE1-CG 3.86Å; F297-M301 HydrophobicContact CE1-SD 3.28Å; F297-M301 WeakPolarHBondContact CE1-SD 3.29Å; F297-M301 HydrophobicContact CZ-SD 4.25Å; F297-M301 WeakPolarHBondContact O-CG 3.39Å; F297-M301 PolarHBondContact O-N 3.19Å; F297-L328 HydrophobicContact CZ-CB 3.92Å; F297-V329 HydrophobicContact CE2-CB 4.34Å; F297-V329 HydrophobicContact CE2-CG2 4.43Å; F297-V334 HydrophobicContact CD2-CG1 4.43Å; F297-V334 HydrophobicContact CD2-CG2 3.42Å; F297-V334 VanDerWaalsContact CD2-CG2 3.42Å; F297-V334 HydrophobicContact CE2-CB 4.38Å; F297-V334 HydrophobicContact CE2-CG1 4.09Å; F297-V334 HydrophobicContact CE2-CG2 3.34Å; F297-V334 HydrophobicContact CG-CG2 4.34Å; F297-V334 HydrophobicContact CZ-CG2 4.24Å; F297-P335 VanDerWaalsContact CD2-O 3.28Å; F297-P335 WeakPolarHBondContact CD2-O 3.42Å
298	I	97.9	Very high	97.7	Very high	5 Å²	5	42 Å²	42	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-68.4	-37.3	179.9	-50.6	-62.7	0	0	0	111.3	L196 L200 W206 V209 L293 S294 R295 E296 M301 N302	L196-I298 HydrophobicContact CB-CG2 4.1Å; L196-I298 HydrophobicContact CD1-CD1 4.05Å; L196-I298 HydrophobicContact CD2-CD1 3.99Å; L196-I298 HydrophobicContact CD2-CG1 4.42Å; L200-I298 HydrophobicContact CD1-CB 4.4Å; L200-I298 HydrophobicContact CD1-CG2 3.61Å; L200-I298 HydrophobicContact CD2-CB 4.19Å; L200-I298 HydrophobicContact CD2-CG2 4.04Å; L200-I298 HydrophobicContact CG-CB 4.36Å; L200-I298 HydrophobicContact CG-CG2 3.66Å; W206-I298 HydrophobicContact CH2-CB 4.21Å; W206-I298 HydrophobicContact CH2-CG1 4.05Å; V209-I298 HydrophobicContact CG1-CD1 3.94Å; V209-I298 HydrophobicContact CG1-CG1 3.81Å; L293-I298 HydrophobicContact CB-CD1 3.94Å; L293-I298 HydrophobicContact CB-CG1 4.43Å; L293-I298 HydrophobicContact CD1-CD1 3.71Å; L293-I298 HydrophobicContact CG-CD1 4.48Å; S294-I298 PolarHBondContact O-N 3.41Å; R295-I298 PolarHBondContact O-N 2.71Å; E296-I298 PolarHBondContact O-N 3.22Å; I298-M301 HydrophobicContact CD1-SD 4.27Å; I298-M301 WeakPolarHBondContact O-CB 3.08Å; I298-M301 PolarHBondContact O-N 3.13Å; I298-N302 PolarHBondContact O-N 3.2Å
299	Q	97.4	Very high	97.8	Very high	88 Å²	88	43.7 Å²	43.7	41%	0.411	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-43.3	173.8	-73.5	175.1	-32.4	0	0	112.2	L200 R295 E296 N302 S303	L200-Q299 HydrophobicContact CD2-CG 3.68Å; R295-Q299 HydrophobicContact CG-CG 4.47Å; R295-Q299 WeakPolarHBondContact O-CG 3.28Å; R295-Q299 PolarHBondContact O-N 2.74Å; E296-Q299 PolarHBondContact O-N 3.43Å; Q299-N302 PolarHBondContact O-N 3.44Å; Q299-S303 PolarHBondContact O-N 2.93Å; Q299-S303 PolarHBondContact O-OG 2.95Å
300	F	97.8	Very high	97.8	Very high	55 Å²	55	43.2 Å²	43.2	24%	0.241	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-46.9	174.2	173.9	-88.5	0	0	0	111.1	E296 F297 N302 S303 S304 V307 L331 V334 P335	E296-F300 WeakPolarHBondContact O-CB 3.27Å; E296-F300 PolarHBondContact O-N 3.34Å; F297-F300 PolarHBondContact O-N 3.26Å; F300-N302 VanDerWaalsContact C-N 3.28Å; F300-N302 PolarHBondContact O-N 3.35Å; F300-S303 PolarHBondContact O-N 3.23Å; F300-S303 PolarHBondContact O-OG 2.94Å; F300-S304 WeakPolarHBondContact O-CB 3.25Å; F300-S304 PolarHBondContact O-N 3.06Å; F300-V307 HydrophobicContact CD1-CG2 4.24Å; F300-V307 HydrophobicContact CE1-CG2 3.78Å; F300-L331 HydrophobicContact CE1-CD2 4.17Å; F300-L331 HydrophobicContact CZ-CD2 4.44Å; F300-V334 HydrophobicContact CD1-CB 4.42Å; F300-V334 HydrophobicContact CD1-CG2 3.64Å; F300-V334 HydrophobicContact CE1-CB 4.23Å; F300-V334 HydrophobicContact CE1-CG2 3.86Å; F300-V334 HydrophobicContact CG-CG2 4.32Å; F300-P335 HydrophobicContact CB-CG 3.9Å; F300-P335 HydrophobicContact CG-CG 4.43Å
301	M	96.8	Very high	97.8	Very high	20 Å²	20	43.4 Å²	43.4	10%	0.099	23%	0.225	C	C	.	.	H	α-helix	trans	-56.4	-42.4	177.7	-76.7	-175.3	61.4	0	0	112.9	L193 F297 I298 S303 V307 F324 W325 L328	L193-M301 HydrophobicContact CD2-CE 3.81Å; F297-M301 HydrophobicContact CD1-CG 4.08Å; F297-M301 HydrophobicContact CD1-SD 3.72Å; F297-M301 HydrophobicContact CE1-CG 3.86Å; F297-M301 HydrophobicContact CE1-SD 3.28Å; F297-M301 WeakPolarHBondContact CE1-SD 3.29Å; F297-M301 HydrophobicContact CZ-SD 4.25Å; F297-M301 WeakPolarHBondContact O-CG 3.39Å; F297-M301 PolarHBondContact O-N 3.19Å; I298-M301 HydrophobicContact CD1-SD 4.27Å; I298-M301 WeakPolarHBondContact O-CB 3.08Å; I298-M301 PolarHBondContact O-N 3.13Å; M301-S303 VanDerWaalsContact C-N 3.27Å; M301-S303 PolarHBondContact O-N 3.4Å; M301-V307 HydrophobicContact CB-CG1 4.15Å; M301-V307 HydrophobicContact CE-CG1 4.26Å; M301-V307 HydrophobicContact CG-CG1 4.17Å; M301-F324 HydrophobicContact CE-CE1 3.69Å; M301-F324 HydrophobicContact CE-CZ 4.11Å; M301-W325 HydrophobicContact CE-CE3 4.46Å; M301-W325 HydrophobicContact CE-CH2 4.13Å; M301-W325 HydrophobicContact CE-CZ3 3.53Å; M301-W325 HydrophobicContact SD-CE3 4.49Å; M301-W325 HydrophobicContact SD-CZ3 3.76Å; M301-L328 HydrophobicContact CE-CD1 3.76Å; M301-L328 HydrophobicContact CG-CD1 4.19Å; M301-L328 HydrophobicContact SD-CD1 4.03Å
302	N	94.5	Very high	97.8	Very high	117 Å²	117	46.1 Å²	46.1	63%	0.626	25%	0.247	S	C	*	.	H	α-helix	trans	-70.3	-23.2	-177.1	-169.4	65.5	0	0	0	113.4	L200 I298 Q299 F300	L200-N302 HydrophobicContact CD1-CB 3.87Å; I298-N302 PolarHBondContact O-N 3.2Å; Q299-N302 PolarHBondContact O-N 3.44Å; F300-N302 VanDerWaalsContact C-N 3.28Å; F300-N302 PolarHBondContact O-N 3.35Å
303	S	95.6	Very high	97.8	Very high	96 Å²	96	47.2 Å²	47.2	67%	0.671	25%	0.251	S	S	*	.	H	α-helix	trans	-105.6	-17.9	-176.4	52.6	0	0	0	0	114.2	Q299 F300 M301	Q299-S303 PolarHBondContact O-N 2.93Å; Q299-S303 PolarHBondContact O-OG 2.95Å; F300-S303 PolarHBondContact O-N 3.23Å; F300-S303 PolarHBondContact O-OG 2.94Å; M301-S303 VanDerWaalsContact C-N 3.27Å; M301-S303 PolarHBondContact O-N 3.4Å
304	S	97.8	Very high	97.8	Very high	20 Å²	20	47.1 Å²	47.1	14%	0.14	25%	0.251	C	S	.	.			trans	-81.8	120.1	-173.6	178.5	0	0	0	0	113.2	F300 V306 V307 R308	F300-S304 WeakPolarHBondContact O-CB 3.25Å; F300-S304 PolarHBondContact O-N 3.06Å; S304-V306 VanDerWaalsContact C-N 3.26Å; S304-V306 PolarHBondContact O-N 2.9Å; S304-V306 PolarHBondContact OG-N 3.12Å; S304-V307 PolarHBondContact O-N 2.71Å; S304-V307 PolarHBondContact OG-N 3.35Å; S304-R308 PolarHBondContact O-N 2.88Å; S304-R308 VanDerWaalsContact O-N 3.09Å
305	A	97.5	Very high	97.8	Very high	48 Å²	48	51.5 Å²	51.5	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-35.9	171.9	0	0	0	0	0	112.1	V307 R308 D309	A305-V307 VanDerWaalsContact C-N 3.33Å; A305-V307 PolarHBondContact O-N 3Å; A305-R308 PolarHBondContact O-N 2.82Å; A305-D309 PolarHBondContact O-N 3.36Å
306	V	98.3	Very high	97.8	Very high	44 Å²	44	51.3 Å²	51.3	27%	0.267	27%	0.273	S	S	.	.	H	α-helix	trans	-60.5	-44.1	177.1	176	0	0	0	0	111	H280 I282 S304 F310 L331	H280-V306 HydrophobicContact CB-CG1 4.05Å; I282-V306 HydrophobicContact CD1-CG1 3.98Å; S304-V306 VanDerWaalsContact C-N 3.26Å; S304-V306 PolarHBondContact O-N 2.9Å; S304-V306 PolarHBondContact OG-N 3.12Å; V306-F310 WeakPolarHBondContact O-CB 3.29Å; V306-F310 PolarHBondContact O-N 3.07Å; V306-L331 HydrophobicContact CG1-CD1 4.29Å; V306-L331 HydrophobicContact CG1-CD2 4.05Å
307	V	98.1	Very high	97.8	Very high	5 Å²	5	47 Å²	47	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-41.3	178.3	175.3	0	0	0	0	111	F300 M301 S304 A305 F310 L311 F324 L328 L331	F300-V307 HydrophobicContact CD1-CG2 4.24Å; F300-V307 HydrophobicContact CE1-CG2 3.78Å; M301-V307 HydrophobicContact CB-CG1 4.15Å; M301-V307 HydrophobicContact CE-CG1 4.26Å; M301-V307 HydrophobicContact CG-CG1 4.17Å; S304-V307 PolarHBondContact O-N 2.71Å; S304-V307 PolarHBondContact OG-N 3.35Å; A305-V307 VanDerWaalsContact C-N 3.33Å; A305-V307 PolarHBondContact O-N 3Å; V307-F310 PolarHBondContact O-N 3.08Å; V307-L311 WeakPolarHBondContact O-CB 3.2Å; V307-L311 PolarHBondContact O-N 2.83Å; V307-F324 HydrophobicContact CG1-CZ 4.29Å; V307-L328 HydrophobicContact CG1-CD1 3.89Å; V307-L328 HydrophobicContact CG1-CD2 4.34Å; V307-L328 HydrophobicContact CG2-CD2 3.96Å; V307-L331 HydrophobicContact CG2-CD2 4.29Å
308	R	98.3	Very high	97.8	Very high	169 Å²	169	49.6 Å²	49.6	64%	0.638	26%	0.263	S	S	*	.	H	α-helix	trans	-61.9	-44.9	177	-177.6	178.6	59.4	-165.5	-6	112.1	S304 A305 F310 L311 A312	S304-R308 PolarHBondContact O-N 2.88Å; S304-R308 VanDerWaalsContact O-N 3.09Å; A305-R308 PolarHBondContact O-N 2.82Å; R308-F310 VanDerWaalsContact C-N 3.34Å; R308-L311 PolarHBondContact O-N 3.15Å; R308-A312 PolarHBondContact O-N 3.45Å
309	D	98.6	Very high	97.8	Very high	61 Å²	61	49.5 Å²	49.5	33%	0.326	26%	0.263	S	S	.	.	H	α-helix	trans	-67.2	-38.3	178.7	-62.9	-13.8	0	0	0	111	P279 H280 A305 A312 W313	P279-D309 HydrophobicContact CB-CB 4.38Å; P279-D309 HydrophobicContact CG-CB 4.12Å; H280-D309 IonicContact CD2-OD2 3.54Å; H280-D309 IonicContact CE1-OD2 2.71Å; H280-D309 IonicContact NE2-OD2 3.47Å; H280-D309 PolarHBondContact NE2-OD2 2.98Å; A305-D309 PolarHBondContact O-N 3.36Å; D309-A312 PolarHBondContact O-N 3.04Å; D309-W313 WeakPolarHBondContact O-CB 3.4Å; D309-W313 PolarHBondContact O-N 3.43Å
310	F	98.7	Very high	97.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-42.8	174.4	-176.9	-122.7	0	0	0	112.3	P278 P279 I282 M284 V306 V307 R308 A312 W313 S314 F324 T327 L328	P278-F310 HydrophobicContact CB-CD2 4.48Å; P278-F310 HydrophobicContact CB-CE2 4.35Å; P279-F310 HydrophobicContact CG-CB 4.5Å; I282-F310 HydrophobicContact CD1-CB 3.68Å; I282-F310 HydrophobicContact CD1-CD2 3.8Å; I282-F310 HydrophobicContact CD1-CG 3.78Å; I282-F310 HydrophobicContact CG2-CD2 4.22Å; I282-F310 HydrophobicContact CG2-CE2 4.03Å; I282-F310 HydrophobicContact CG2-CZ 4.41Å; M284-F310 HydrophobicContact CE-CE2 4.21Å; M284-F310 HydrophobicContact CE-CZ 4.01Å; M284-F310 HydrophobicContact SD-CE2 3.6Å; M284-F310 VanDerWaalsContact SD-CE2 3.6Å; M284-F310 HydrophobicContact SD-CZ 3.8Å; V306-F310 WeakPolarHBondContact O-CB 3.29Å; V306-F310 PolarHBondContact O-N 3.07Å; V307-F310 PolarHBondContact O-N 3.08Å; R308-F310 VanDerWaalsContact C-N 3.34Å; F310-A312 VanDerWaalsContact C-N 3.35Å; F310-A312 PolarHBondContact O-N 3.1Å; F310-W313 HydrophobicContact CD2-CE3 4.02Å; F310-W313 AromaticContact CE2-CE3 3.75Å; F310-W313 HydrophobicContact CE2-CE3 3.75Å; F310-W313 AromaticContact CE2-CZ3 3.84Å; F310-W313 HydrophobicContact CE2-CZ3 3.84Å; F310-W313 CarbonylContact O-C 3.57Å; F310-W313 WeakPolarHBondContact O-CB 3.18Å; F310-W313 PolarHBondContact O-N 3.4Å; F310-S314 PolarHBondContact O-N 3.29Å; F310-S314 PolarHBondContact O-OG 2.76Å; F310-F324 AromaticContact CD1-CD2 3.62Å; F310-F324 HydrophobicContact CD1-CD2 3.62Å; F310-F324 AromaticContact CD1-CE2 3.6Å; F310-F324 HydrophobicContact CD1-CE2 3.6Å; F310-F324 AromaticContact CE1-CD2 3.53Å; F310-F324 HydrophobicContact CE1-CD2 3.53Å; F310-F324 HydrophobicContact CE1-CE2 4.01Å; F310-F324 HydrophobicContact CE1-CG 4.3Å; F310-T327 HydrophobicContact CE1-CG2 3.8Å; F310-T327 HydrophobicContact CE2-CG2 4.21Å; F310-T327 HydrophobicContact CZ-CG2 3.49Å; F310-T327 VanDerWaalsContact CZ-CG2 3.49Å; F310-L328 HydrophobicContact CD1-CD2 3.74Å; F310-L328 HydrophobicContact CD1-CG 4.18Å; F310-L328 HydrophobicContact CE1-CD2 4.21Å; F310-L328 HydrophobicContact CE1-CG 4.29Å
311	L	98.6	Very high	97.9	Very high	40 Å²	40	43.5 Å²	43.5	21%	0.209	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-44.6	175.1	178.1	60.5	0	0	0	111.5	I186 L189 L193 V307 R308 W313 S314 E315 F324	I186-L311 HydrophobicContact CD1-CD1 4.26Å; L189-L311 HydrophobicContact CD2-CD1 3.82Å; L189-L311 HydrophobicContact CG-CD1 4.49Å; L193-L311 HydrophobicContact CD1-CD1 3.7Å; L193-L311 HydrophobicContact CD1-CD2 3.68Å; L193-L311 HydrophobicContact CD1-CG 4.37Å; V307-L311 WeakPolarHBondContact O-CB 3.2Å; V307-L311 PolarHBondContact O-N 2.83Å; R308-L311 PolarHBondContact O-N 3.15Å; L311-W313 VanDerWaalsContact C-N 3.3Å; L311-W313 PolarHBondContact O-N 3.27Å; L311-S314 PolarHBondContact O-N 3.03Å; L311-S314 VanDerWaalsContact O-N 3.12Å; L311-E315 WeakPolarHBondContact O-CG 3.16Å; L311-E315 PolarHBondContact O-N 3.23Å; L311-F324 HydrophobicContact CB-CE2 3.73Å; L311-F324 HydrophobicContact CB-CZ 4.01Å; L311-F324 HydrophobicContact CD1-CD2 4.38Å; L311-F324 HydrophobicContact CD1-CE2 3.82Å; L311-F324 HydrophobicContact CD1-CZ 3.94Å; L311-F324 HydrophobicContact CG-CE2 4.36Å; L311-F324 HydrophobicContact CG-CZ 4.44Å
312	A	98.5	Very high	98	Very high	57 Å²	57	44.7 Å²	44.7	47%	0.471	24%	0.242	S	C	.	.	H	α-helix	trans	-59.9	-42.4	174.9	0	0	0	0	0	111.4	R308 D309 F310 S314 E315	R308-A312 PolarHBondContact O-N 3.45Å; D309-A312 PolarHBondContact O-N 3.04Å; F310-A312 VanDerWaalsContact C-N 3.35Å; F310-A312 PolarHBondContact O-N 3.1Å; A312-S314 VanDerWaalsContact C-N 3.29Å; A312-S314 PolarHBondContact O-N 2.84Å; A312-E315 PolarHBondContact O-N 3.03Å
313	W	98.7	Very high	98.2	Very high	24 Å²	24	39.2 Å²	39.2	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-31.1	174.9	178.1	93.1	0	0	0	112.8	F251 K275 S276 P277 P278 P279 M284 D309 F310 L311 T317	F251-W313 HydrophobicContact CB-CH2 3.87Å; F251-W313 HydrophobicContact CB-CZ3 4.39Å; F251-W313 HydrophobicContact CD2-CH2 4.28Å; F251-W313 HydrophobicContact CG-CH2 4.41Å; K275-W313 VanDerWaalsContact CE-CE2 3.45Å; K275-W313 VanDerWaalsContact CE-O 3.29Å; K275-W313 WeakPolarHBondContact CE-O 3.1Å; K275-W313 PolarHBondContact NZ-O 3.04Å; S276-W313 PolarHBondContact O-NE1 3.4Å; P277-W313 PolarHBondContact O-NE1 3.21Å; P278-W313 HydrophobicContact CB-CH2 4.47Å; P278-W313 HydrophobicContact CB-CZ2 4.4Å; P278-W313 HydrophobicContact CG-CH2 3.79Å; P278-W313 HydrophobicContact CG-CZ2 3.81Å; P278-W313 HydrophobicContact CG-CZ3 4.27Å; P279-W313 HydrophobicContact CG-CB 4.25Å; M284-W313 HydrophobicContact CE-CH2 4.14Å; M284-W313 HydrophobicContact CE-CZ3 3.85Å; M284-W313 HydrophobicContact SD-CH2 4.07Å; M284-W313 HydrophobicContact SD-CZ3 3.91Å; D309-W313 WeakPolarHBondContact O-CB 3.4Å; D309-W313 PolarHBondContact O-N 3.43Å; F310-W313 HydrophobicContact CD2-CE3 4.02Å; F310-W313 AromaticContact CE2-CE3 3.75Å; F310-W313 HydrophobicContact CE2-CE3 3.75Å; F310-W313 AromaticContact CE2-CZ3 3.84Å; F310-W313 HydrophobicContact CE2-CZ3 3.84Å; F310-W313 CarbonylContact O-C 3.57Å; F310-W313 WeakPolarHBondContact O-CB 3.18Å; F310-W313 PolarHBondContact O-N 3.4Å; L311-W313 VanDerWaalsContact C-N 3.3Å; L311-W313 PolarHBondContact O-N 3.27Å; W313-T317 HydrophobicContact CZ3-CG2 4.29Å
314	S	98.4	Very high	98.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.6	179	-64.6	0	0	0	0	114.9	F310 L311 A312 D316 T317	F310-S314 PolarHBondContact O-N 3.29Å; F310-S314 PolarHBondContact O-OG 2.76Å; L311-S314 PolarHBondContact O-N 3.03Å; L311-S314 VanDerWaalsContact O-N 3.12Å; A312-S314 VanDerWaalsContact C-N 3.29Å; A312-S314 PolarHBondContact O-N 2.84Å; S314-D316 VanDerWaalsContact C-N 3.27Å; S314-D316 PolarHBondContact O-N 2.69Å; S314-T317 PolarHBondContact O-N 2.64Å; S314-T317 PolarHBondContact O-OG1 2.85Å
315	E	98.1	Very high	98.4	Very high	92 Å²	92	33.8 Å²	33.8	43%	0.43	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-30.4	-171.2	-69.7	-160.7	132.6	0	0	114.8	I186 K190 L311 A312	I186-E315 WeakPolarHBondContact CB-O 3.49Å; I186-E315 HydrophobicContact CG1-CB 4.42Å; I186-E315 HydrophobicContact CG1-CG 4.3Å; I186-E315 WeakPolarHBondContact CG2-O 3.47Å; K190-E315 WeakPolarHBondContact CE-OE1 3.28Å; K190-E315 IonicContact NZ-OE1 3.74Å; K190-E315 PolarHBondContact NZ-OE1 3.18Å; L311-E315 WeakPolarHBondContact O-CG 3.16Å; L311-E315 PolarHBondContact O-N 3.23Å; A312-E315 PolarHBondContact O-N 3.03Å
316	D	97.9	Very high	98.4	Very high	43 Å²	43	31.5 Å²	31.5	23%	0.23	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	29.6	-176.6	67.1	-11.1	0	0	0	112	R254 Y255 K275 S314	R254-D316 CarbonylContact C-O 3.55Å; R254-D316 WeakPolarHBondContact CA-O 3.35Å; R254-D316 WeakPolarHBondContact CD-OD2 3.44Å; R254-D316 HydrophobicContact CG-CB 3.98Å; R254-D316 WeakPolarHBondContact CG-OD2 3.4Å; R254-D316 IonicContact NE-OD2 3.83Å; R254-D316 PolarHBondContact NE-OD2 3.48Å; Y255-D316 PolarHBondContact N-O 2.91Å; K275-D316 IonicContact NZ-OD1 3.11Å; K275-D316 PolarHBondContact NZ-OD1 2.68Å; K275-D316 IonicContact NZ-OD2 3.52Å; S314-D316 VanDerWaalsContact C-N 3.27Å; S314-D316 PolarHBondContact O-N 2.69Å
317	T	98.5	Very high	98.4	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	14%	0.144	C	C	.	.	S	Bend	trans	-96	167.7	168	67.2	0	0	0	0	111.4	R250 F251 K275 W313 S314 H323	R250-T317 WeakPolarHBondContact O-CB 3.41Å; F251-T317 HydrophobicContact CB-CG2 3.92Å; K275-T317 HydrophobicContact CD-CG2 3.9Å; W313-T317 HydrophobicContact CZ3-CG2 4.29Å; S314-T317 PolarHBondContact O-N 2.64Å; S314-T317 PolarHBondContact O-OG1 2.85Å; T317-H323 PolarHBondContact OG1-CE1 3.29Å; T317-H323 PolarHBondContact OG1-NE2 2.79Å
318	Y	98.4	Very high	98.5	Very high	55 Å²	55	29.5 Å²	29.5	22%	0.216	14%	0.143	C	C	.	.	S	Bend	trans	-91.7	127.4	174.4	-171.7	-81.5	0	0	0	111.1	A184 R250 Y255 P268	A184-Y318 HydrophobicContact CB-CD1 4.26Å; A184-Y318 HydrophobicContact CB-CD2 4.28Å; A184-Y318 HydrophobicContact CB-CE1 3.76Å; A184-Y318 HydrophobicContact CB-CE2 3.78Å; A184-Y318 HydrophobicContact CB-CG 4.49Å; A184-Y318 VanDerWaalsContact CB-CZ 3.49Å; R250-Y318 WeakPolarHBondContact CB-O 3.39Å; R250-Y318 HydrophobicContact CG-CD1 3.96Å; R250-Y318 HydrophobicContact CG-CG 4.49Å; R250-Y318 PolarHBondContact O-N 2.97Å; Y255-Y318 AromaticContact CD1-CD2 3.69Å; Y255-Y318 HydrophobicContact CD1-CD2 3.69Å; Y255-Y318 HydrophobicContact CD1-CG 4.18Å; Y255-Y318 AromaticContact CE1-CD2 3.61Å; Y255-Y318 HydrophobicContact CE1-CD2 3.61Å; Y255-Y318 AromaticContact CE1-CG 3.91Å; Y255-Y318 HydrophobicContact CE1-CG 3.91Å; P268-Y318 HydrophobicContact CB-CD2 4.05Å; P268-Y318 HydrophobicContact CG-CD2 4.29Å
319	S	98.4	Very high	98.5	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.021	11%	0.113	C	C	.	.			trans	48.5	60.5	-175.5	-64.5	0	0	0	0	112.9	A184 D321 E322 H323	A184-S319 VanDerWaalsContact CB-OG 3.3Å; A184-S319 WeakPolarHBondContact CB-OG 3.33Å; A184-S319 WeakPolarHBondContact O-CA 3.21Å; A184-S319 PolarHBondContact O-N 2.72Å; S319-D321 VanDerWaalsContact CA-OD1 3.29Å; S319-D321 WeakPolarHBondContact CA-OD1 3.31Å; S319-D321 PolarHBondContact O-N 3.49Å; S319-E322 PolarHBondContact O-N 3.29Å; S319-H323 PolarHBondContact O-ND1 2.95Å; S319-H323 VanDerWaalsContact O-ND1 3.14Å
320	P	98.5	Very high	98.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-57.8	-29	176.4	23.4	-32.7	0	0	0	113.8	I186 L189 E322 H323 F324	I186-P320 HydrophobicContact CB-CG 4.04Å; I186-P320 HydrophobicContact CD1-CB 3.83Å; I186-P320 HydrophobicContact CD1-CG 3.56Å; I186-P320 HydrophobicContact CG1-CG 4.4Å; L189-P320 HydrophobicContact CD2-CB 4.13Å; P320-E322 PolarHBondContact O-N 3.03Å; P320-H323 WeakPolarHBondContact CA-CE1 3.29Å; P320-H323 PolarHBondContact O-N 3.47Å; P320-H323 VanDerWaalsContact O-N 3.14Å; P320-F324 WeakPolarHBondContact O-CB 3.48Å; P320-F324 PolarHBondContact O-N 3.22Å
321	D	98.3	Very high	98.4	Very high	17 Å²	17	19.2 Å²	19.2	9%	0.091	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-58.5	-25.2	171.9	56.1	-44.6	0	0	0	113.7	R188 L189 A289 S319	R188-D321 HydrophobicContact CG-CB 4.29Å; L189-D321 HydrophobicContact CB-CB 4.48Å; A289-D321 WeakPolarHBondContact CA-O 3.19Å; A289-D321 HydrophobicContact CB-CB 3.94Å; S319-D321 VanDerWaalsContact CA-OD1 3.29Å; S319-D321 WeakPolarHBondContact CA-OD1 3.31Å; S319-D321 PolarHBondContact O-N 3.49Å
322	E	98.3	Very high	98.3	Very high	46 Å²	46	21 Å²	21	22%	0.215	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-93	6.7	178	-66.5	-172.7	-154	0	0	114.3	K247 R250 I286 G287 S319 P320	K247-E322 IonicContact NZ-OE2 3.57Å; K247-E322 PolarHBondContact NZ-OE2 3.45Å; R250-E322 IonicContact CZ-OE2 3.53Å; R250-E322 VanDerWaalsContact NH1-CD 3.35Å; R250-E322 IonicContact NH1-OE1 3.53Å; R250-E322 IonicContact NH1-OE2 3.65Å; R250-E322 PolarHBondContact NH1-OE2 3.38Å; R250-E322 IonicContact NH2-OE2 2.71Å; I286-E322 WeakPolarHBondContact CA-O 3.45Å; G287-E322 PolarHBondContact N-O 2.87Å; G287-E322 WeakPolarHBondContact O-CB 3.39Å; S319-E322 PolarHBondContact O-N 3.29Å; P320-E322 PolarHBondContact O-N 3.03Å
323	H	98.6	Very high	98.1	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.009	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.3	-26.1	174	54.6	-99.7	0	0	0	114.5	M284 F285 I286 T317 S319 P320 T327	M284-H323 HydrophobicContact CE-CB 4.13Å; F285-H323 WeakPolarHBondContact O-CA 3.44Å; F285-H323 VanDerWaalsContact O-CB 3.3Å; F285-H323 WeakPolarHBondContact O-CB 3.31Å; I286-H323 HydrophobicContact CG2-CB 4.29Å; T317-H323 PolarHBondContact OG1-CE1 3.29Å; T317-H323 PolarHBondContact OG1-NE2 2.79Å; S319-H323 PolarHBondContact O-ND1 2.95Å; S319-H323 VanDerWaalsContact O-ND1 3.14Å; P320-H323 WeakPolarHBondContact CA-CE1 3.29Å; P320-H323 PolarHBondContact O-N 3.47Å; P320-H323 VanDerWaalsContact O-N 3.14Å; H323-T327 WeakPolarHBondContact O-CB 3.47Å; H323-T327 PolarHBondContact O-N 2.83Å; H323-T327 PolarHBondContact O-OG1 3.49Å
324	F	98.8	Very high	98	Very high	1 Å²	1	20.3 Å²	20.3	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-53.8	-178.1	-177.3	-99.8	0	0	0	111.8	L189 L193 M301 V307 F310 L311 P320 T327 L328	L189-F324 HydrophobicContact CD1-CB 4.5Å; L189-F324 HydrophobicContact CD1-CD1 3.72Å; L189-F324 HydrophobicContact CD1-CE1 4.24Å; L189-F324 HydrophobicContact CD1-CG 4.32Å; L189-F324 HydrophobicContact CD2-CB 3.68Å; L189-F324 HydrophobicContact CD2-CD1 3.69Å; L189-F324 HydrophobicContact CD2-CD2 3.98Å; L189-F324 HydrophobicContact CD2-CE1 4.24Å; L189-F324 HydrophobicContact CD2-CG 3.51Å; L189-F324 HydrophobicContact CG-CD1 4.33Å; L193-F324 HydrophobicContact CD2-CE1 4.42Å; M301-F324 HydrophobicContact CE-CE1 3.69Å; M301-F324 HydrophobicContact CE-CZ 4.11Å; V307-F324 HydrophobicContact CG1-CZ 4.29Å; F310-F324 AromaticContact CD1-CD2 3.62Å; F310-F324 HydrophobicContact CD1-CD2 3.62Å; F310-F324 AromaticContact CD1-CE2 3.6Å; F310-F324 HydrophobicContact CD1-CE2 3.6Å; F310-F324 AromaticContact CE1-CD2 3.53Å; F310-F324 HydrophobicContact CE1-CD2 3.53Å; F310-F324 HydrophobicContact CE1-CE2 4.01Å; F310-F324 HydrophobicContact CE1-CG 4.3Å; L311-F324 HydrophobicContact CB-CE2 3.73Å; L311-F324 HydrophobicContact CB-CZ 4.01Å; L311-F324 HydrophobicContact CD1-CD2 4.38Å; L311-F324 HydrophobicContact CD1-CE2 3.82Å; L311-F324 HydrophobicContact CD1-CZ 3.94Å; L311-F324 HydrophobicContact CG-CE2 4.36Å; L311-F324 HydrophobicContact CG-CZ 4.44Å; P320-F324 WeakPolarHBondContact O-CB 3.48Å; P320-F324 PolarHBondContact O-N 3.22Å; F324-T327 PolarHBondContact O-N 3.1Å; F324-L328 HydrophobicContact CD1-CD1 3.95Å; F324-L328 HydrophobicContact CE1-CD1 3.38Å; F324-L328 HydrophobicContact CE1-CG 4.34Å; F324-L328 HydrophobicContact CE2-CD1 4.04Å; F324-L328 HydrophobicContact CE2-CG 4.45Å; F324-L328 HydrophobicContact CZ-CD1 3.44Å; F324-L328 VanDerWaalsContact CZ-CD1 3.44Å; F324-L328 HydrophobicContact CZ-CG 4.3Å; F324-L328 WeakPolarHBondContact O-CB 3.49Å; F324-L328 WeakPolarHBondContact O-CG 3.37Å; F324-L328 PolarHBondContact O-N 3.28Å
325	W	98.6	Very high	97.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.8	-48.1	179.8	-53.1	121.9	0	0	0	112.4	L189 D192 L193 L196 L238 F291 L293 M301 T327 L328 V329	L189-W325 HydrophobicContact CD1-CD2 4.34Å; L189-W325 HydrophobicContact CD1-CH2 3.94Å; L189-W325 HydrophobicContact CD1-CZ2 3.14Å; D192-W325 HydrophobicContact CB-CZ2 4.17Å; L193-W325 HydrophobicContact CD2-CH2 3.74Å; L193-W325 HydrophobicContact CD2-CZ3 4.48Å; L193-W325 HydrophobicContact CG-CH2 4.34Å; L196-W325 HydrophobicContact CD1-CH2 3.6Å; L196-W325 HydrophobicContact CD1-CZ2 4.4Å; L196-W325 HydrophobicContact CD1-CZ3 4.24Å; L238-W325 HydrophobicContact CD1-CB 3.64Å; F291-W325 AromaticContact CD1-CD1 3.89Å; F291-W325 AromaticContact CD1-CD2 3.78Å; F291-W325 HydrophobicContact CD1-CD2 3.78Å; F291-W325 AromaticContact CD1-CE2 3.72Å; F291-W325 HydrophobicContact CD1-CE3 4.34Å; F291-W325 AromaticContact CD1-CG 3.91Å; F291-W325 HydrophobicContact CD1-CG 3.91Å; F291-W325 HydrophobicContact CD1-CZ2 4.24Å; F291-W325 AromaticContact CD1-NE1 3.77Å; F291-W325 AromaticContact CE1-CD2 3.87Å; F291-W325 HydrophobicContact CE1-CD2 3.87Å; F291-W325 AromaticContact CE1-CE2 3.37Å; F291-W325 HydrophobicContact CE1-CE3 4.34Å; F291-W325 HydrophobicContact CE1-CG 4.39Å; F291-W325 AromaticContact CE1-CH2 4Å; F291-W325 HydrophobicContact CE1-CH2 4Å; F291-W325 AromaticContact CE1-CZ2 3.45Å; F291-W325 HydrophobicContact CE1-CZ2 3.45Å; F291-W325 VanDerWaalsContact CE1-CZ2 3.45Å; F291-W325 HydrophobicContact CE1-CZ3 4.38Å; F291-W325 AromaticContact CE1-NE1 3.64Å; F291-W325 HydrophobicContact CZ-CH2 4.29Å; F291-W325 HydrophobicContact CZ-CZ2 4.09Å; L293-W325 HydrophobicContact CD1-CE3 4.07Å; L293-W325 HydrophobicContact CD1-CZ3 4.11Å; M301-W325 HydrophobicContact CE-CE3 4.46Å; M301-W325 HydrophobicContact CE-CH2 4.13Å; M301-W325 HydrophobicContact CE-CZ3 3.53Å; M301-W325 HydrophobicContact SD-CE3 4.49Å; M301-W325 HydrophobicContact SD-CZ3 3.76Å; W325-T327 PolarHBondContact O-N 3.26Å; W325-L328 PolarHBondContact O-N 3.29Å; W325-V329 PolarHBondContact O-N 3.46Å
326	A	98.6	Very high	97.7	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-60.3	-34.9	179.5	0	0	0	0	0	112.6	T240 F285 I286 V329	T240-A326 PolarHBondContact OG1-O 3.49Å; F285-A326 HydrophobicContact CB-CB 4.26Å; F285-A326 WeakPolarHBondContact CB-O 3.43Å; I286-A326 WeakPolarHBondContact O-CB 3.37Å; A326-V329 WeakPolarHBondContact O-CG1 3.11Å
327	T	98.8	Very high	97.6	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-74.6	-46.6	175.5	-62.2	0	0	0	0	111.2	I282 E283 M284 F285 F310 H323 F324 W325 V329 R330 L331	I282-T327 HydrophobicContact CG2-CG2 3.32Å; E283-T327 WeakPolarHBondContact O-CG2 3.32Å; M284-T327 HydrophobicContact SD-CG2 4.23Å; F285-T327 PolarHBondContact N-OG1 2.89Å; F285-T327 PolarHBondContact O-OG1 3.46Å; F310-T327 HydrophobicContact CE1-CG2 3.8Å; F310-T327 HydrophobicContact CE2-CG2 4.21Å; F310-T327 HydrophobicContact CZ-CG2 3.49Å; F310-T327 VanDerWaalsContact CZ-CG2 3.49Å; H323-T327 WeakPolarHBondContact O-CB 3.47Å; H323-T327 PolarHBondContact O-N 2.83Å; H323-T327 PolarHBondContact O-OG1 3.49Å; F324-T327 PolarHBondContact O-N 3.1Å; W325-T327 PolarHBondContact O-N 3.26Å; T327-V329 PolarHBondContact O-N 2.94Å; T327-R330 CarbonylContact O-C 3.51Å; T327-R330 PolarHBondContact O-N 3.21Å; T327-R330 VanDerWaalsContact O-N 3.09Å; T327-L331 PolarHBondContact O-N 3.04Å
328	L	98.4	Very high	97.5	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-63.6	-38.1	-177.6	-76.4	-170.5	0	0	0	113.2	F297 M301 V307 F310 F324 W325 R330 L331 V334	F297-L328 HydrophobicContact CZ-CB 3.92Å; M301-L328 HydrophobicContact CE-CD1 3.76Å; M301-L328 HydrophobicContact CG-CD1 4.19Å; M301-L328 HydrophobicContact SD-CD1 4.03Å; V307-L328 HydrophobicContact CG1-CD1 3.89Å; V307-L328 HydrophobicContact CG1-CD2 4.34Å; V307-L328 HydrophobicContact CG2-CD2 3.96Å; F310-L328 HydrophobicContact CD1-CD2 3.74Å; F310-L328 HydrophobicContact CD1-CG 4.18Å; F310-L328 HydrophobicContact CE1-CD2 4.21Å; F310-L328 HydrophobicContact CE1-CG 4.29Å; F324-L328 HydrophobicContact CD1-CD1 3.95Å; F324-L328 HydrophobicContact CE1-CD1 3.38Å; F324-L328 HydrophobicContact CE1-CG 4.34Å; F324-L328 HydrophobicContact CE2-CD1 4.04Å; F324-L328 HydrophobicContact CE2-CG 4.45Å; F324-L328 HydrophobicContact CZ-CD1 3.44Å; F324-L328 VanDerWaalsContact CZ-CD1 3.44Å; F324-L328 HydrophobicContact CZ-CG 4.3Å; F324-L328 WeakPolarHBondContact O-CB 3.49Å; F324-L328 WeakPolarHBondContact O-CG 3.37Å; F324-L328 PolarHBondContact O-N 3.28Å; W325-L328 PolarHBondContact O-N 3.29Å; L328-R330 PolarHBondContact O-N 3.21Å; L328-R330 VanDerWaalsContact O-N 3.16Å; L328-L331 HydrophobicContact CD2-CD2 4.3Å; L328-L331 WeakPolarHBondContact O-CB 3.49Å; L328-L331 PolarHBondContact O-N 3.23Å; L328-V334 WeakPolarHBondContact O-CG1 3.41Å
329	V	98.3	Very high	97.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.9	177.4	76.4	0	0	0	0	113.1	L238 T240 F297 W325 A326 T327 E337 V338	L238-V329 HydrophobicContact CD1-CB 4.33Å; L238-V329 HydrophobicContact CD1-CG1 4.07Å; L238-V329 HydrophobicContact CD2-CB 3.85Å; L238-V329 HydrophobicContact CD2-CG1 3.97Å; L238-V329 HydrophobicContact CD2-CG2 3.69Å; L238-V329 HydrophobicContact CG-CB 4.44Å; L238-V329 HydrophobicContact CG-CG1 4.08Å; T240-V329 HydrophobicContact CG2-CG1 3.76Å; F297-V329 HydrophobicContact CE2-CB 4.34Å; F297-V329 HydrophobicContact CE2-CG2 4.43Å; W325-V329 PolarHBondContact O-N 3.46Å; A326-V329 WeakPolarHBondContact O-CG1 3.11Å; T327-V329 PolarHBondContact O-N 2.94Å; V329-E337 CarbonylContact O-C 3.55Å; V329-E337 WeakPolarHBondContact O-CA 3.37Å; V329-V338 HydrophobicContact CG2-CB 4.44Å; V329-V338 HydrophobicContact CG2-CG2 3.95Å; V329-V338 PolarHBondContact O-N 2.84Å
330	R	98.3	Very high	97.3	Very high	1 Å²	1	22.5 Å²	22.5	0%	0.004	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	15.6	175.4	-54.8	-160.2	176.6	-121.7	9.1	113.4	T240 F285 T327 L328 P332 V338 P339 R340 Q342 P343	T240-R330 HydrophobicContact CG2-CG 4.35Å; T240-R330 PolarHBondContact O-NH2 3.29Å; T240-R330 WeakPolarHBondContact OG1-CD 3.38Å; T240-R330 WeakPolarHBondContact OG1-CG 2.87Å; T240-R330 PolarHBondContact OG1-NE 3.03Å; F285-R330 VanDerWaalsContact CD1-CD 3.47Å; F285-R330 HydrophobicContact CD2-CB 3.86Å; F285-R330 HydrophobicContact CD2-CG 4.21Å; F285-R330 HydrophobicContact CE2-CB 3.75Å; F285-R330 HydrophobicContact CE2-CG 4.31Å; F285-R330 HydrophobicContact CG-CB 4.5Å; F285-R330 HydrophobicContact CG-CG 4.37Å; F285-R330 HydrophobicContact CZ-CB 4.31Å; F285-R330 VanDerWaalsContact CZ-CD 3.49Å; T327-R330 CarbonylContact O-C 3.51Å; T327-R330 PolarHBondContact O-N 3.21Å; T327-R330 VanDerWaalsContact O-N 3.09Å; L328-R330 PolarHBondContact O-N 3.21Å; L328-R330 VanDerWaalsContact O-N 3.16Å; R330-P332 WeakPolarHBondContact O-CD 3.31Å; R330-V338 WeakPolarHBondContact CA-O 3.39Å; R330-V338 WeakPolarHBondContact CB-O 3.45Å; R330-V338 HydrophobicContact CG-CB 4.23Å; R330-V338 VanDerWaalsContact CG-O 3.27Å; R330-V338 WeakPolarHBondContact CG-O 3.34Å; R330-P339 PolarHBondContact NH1-O 2.86Å; R330-R340 HydrophobicContact CB-CG 4.22Å; R330-R340 VanDerWaalsContact O-CG 3.29Å; R330-R340 WeakPolarHBondContact O-CG 3.47Å; R330-R340 PolarHBondContact O-NE 3.38Å; R330-Q342 PolarHBondContact NH1-O 3.38Å; R330-P343 PolarHBondContact NH2-O 3.3Å
331	L	97.6	Very high	97.2	Very high	14 Å²	14	27.7 Å²	27.7	7%	0.073	18%	0.177	C	C	.	.	S	Bend	trans	-77.4	122.6	172.4	-174.7	68.7	0	0	0	109.2	I282 F300 V306 V307 T327 L328 G333 V334	I282-L331 HydrophobicContact CD1-CD1 4.41Å; I282-L331 HydrophobicContact CG1-CD1 3.94Å; F300-L331 HydrophobicContact CE1-CD2 4.17Å; F300-L331 HydrophobicContact CZ-CD2 4.44Å; V306-L331 HydrophobicContact CG1-CD1 4.29Å; V306-L331 HydrophobicContact CG1-CD2 4.05Å; V307-L331 HydrophobicContact CG2-CD2 4.29Å; T327-L331 PolarHBondContact O-N 3.04Å; L328-L331 HydrophobicContact CD2-CD2 4.3Å; L328-L331 WeakPolarHBondContact O-CB 3.49Å; L328-L331 PolarHBondContact O-N 3.23Å; L331-G333 PolarHBondContact O-N 2.91Å; L331-V334 HydrophobicContact CB-CB 4.47Å; L331-V334 WeakPolarHBondContact O-CB 3.38Å; L331-V334 WeakPolarHBondContact O-CG1 3.43Å; L331-V334 PolarHBondContact O-N 3.08Å; L331-V334 VanDerWaalsContact O-N 3.14Å
332	P	96.3	Very high	97.1	Very high	77 Å²	77	31.2 Å²	31.2	50%	0.5	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	127.5	-179.3	-29.5	37.3	0	0	0	112.7	R330 E337	R330-P332 WeakPolarHBondContact O-CD 3.31Å; P332-E337 WeakPolarHBondContact CA-OE1 3.36Å; P332-E337 WeakPolarHBondContact CA-OE2 3.43Å
333	G	93.8	Very high	97	Very high	59 Å²	59	33.8 Å²	33.8	61%	0.608	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	4.1	177.7	0	0	0	0	0	115.3	L331 E337	L331-G333 PolarHBondContact O-N 2.91Å; G333-E337 PolarHBondContact N-OE2 3.33Å
334	V	97.1	Very high	97	Very high	7 Å²	7	36 Å²	36	4%	0.042	23%	0.225	C	C	.	.			trans	-70.6	140.7	171.3	75.7	0	0	0	0	110.7	F297 F300 L328 L331 G336 E337	F297-V334 HydrophobicContact CD2-CG1 4.43Å; F297-V334 HydrophobicContact CD2-CG2 3.42Å; F297-V334 VanDerWaalsContact CD2-CG2 3.42Å; F297-V334 HydrophobicContact CE2-CB 4.38Å; F297-V334 HydrophobicContact CE2-CG1 4.09Å; F297-V334 HydrophobicContact CE2-CG2 3.34Å; F297-V334 HydrophobicContact CG-CG2 4.34Å; F297-V334 HydrophobicContact CZ-CG2 4.24Å; F300-V334 HydrophobicContact CD1-CB 4.42Å; F300-V334 HydrophobicContact CD1-CG2 3.64Å; F300-V334 HydrophobicContact CE1-CB 4.23Å; F300-V334 HydrophobicContact CE1-CG2 3.86Å; F300-V334 HydrophobicContact CG-CG2 4.32Å; L328-V334 WeakPolarHBondContact O-CG1 3.41Å; L331-V334 HydrophobicContact CB-CB 4.47Å; L331-V334 WeakPolarHBondContact O-CB 3.38Å; L331-V334 WeakPolarHBondContact O-CG1 3.43Å; L331-V334 PolarHBondContact O-N 3.08Å; L331-V334 VanDerWaalsContact O-N 3.14Å; V334-G336 PolarHBondContact O-N 3.45Å; V334-E337 HydrophobicContact CG1-CB 3.73Å; V334-E337 HydrophobicContact CG1-CG 4.09Å; V334-E337 WeakPolarHBondContact O-CB 3.2Å; V334-E337 PolarHBondContact O-N 3.42Å; V334-E337 VanDerWaalsContact O-N 3.13Å
335	P	97.2	Very high	97	Very high	40 Å²	40	37.4 Å²	37.4	26%	0.26	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	126.6	176.3	-27.3	36.8	0	0	0	112.5	E296 F297 F300	E296-P335 HydrophobicContact CB-CB 3.8Å; E296-P335 HydrophobicContact CB-CG 4.23Å; F297-P335 VanDerWaalsContact CD2-O 3.28Å; F297-P335 WeakPolarHBondContact CD2-O 3.42Å; F300-P335 HydrophobicContact CB-CG 3.9Å; F300-P335 HydrophobicContact CG-CG 4.43Å
336	G	94.4	Very high	96.9	Very high	20 Å²	20	39.9 Å²	39.9	21%	0.206	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	29.3	-176.6	0	0	0	0	0	114	G234 S236 V334	G234-G336 WeakPolarHBondContact O-CA 3.34Å; S236-G336 PolarHBondContact N-O 3.43Å; V334-G336 PolarHBondContact O-N 3.45Å
337	E	95	Very high	96.7	Very high	60 Å²	60	41.2 Å²	41.2	28%	0.28	26%	0.255	S	S	.	.			trans	-50.4	140	175.1	-173.3	-177.4	166.1	0	0	112.8	V329 P332 G333 V334	V329-E337 CarbonylContact O-C 3.55Å; V329-E337 WeakPolarHBondContact O-CA 3.37Å; P332-E337 WeakPolarHBondContact CA-OE1 3.36Å; P332-E337 WeakPolarHBondContact CA-OE2 3.43Å; G333-E337 PolarHBondContact N-OE2 3.33Å; V334-E337 HydrophobicContact CG1-CB 3.73Å; V334-E337 HydrophobicContact CG1-CG 4.09Å; V334-E337 WeakPolarHBondContact O-CB 3.2Å; V334-E337 PolarHBondContact O-N 3.42Å; V334-E337 VanDerWaalsContact O-N 3.13Å
338	V	96.5	Very high	96.6	Very high	13 Å²	13	43.2 Å²	43.2	8%	0.079	27%	0.265	C	S	.	.			trans	-98.3	107.5	158.8	177.6	0	0	0	0	107.5	T240 V329 R330 R340 Q342 I345	T240-V338 HydrophobicContact CG2-CG1 4.41Å; V329-V338 HydrophobicContact CG2-CB 4.44Å; V329-V338 HydrophobicContact CG2-CG2 3.95Å; V329-V338 PolarHBondContact O-N 2.84Å; R330-V338 WeakPolarHBondContact CA-O 3.39Å; R330-V338 WeakPolarHBondContact CB-O 3.45Å; R330-V338 HydrophobicContact CG-CB 4.23Å; R330-V338 VanDerWaalsContact CG-O 3.27Å; R330-V338 WeakPolarHBondContact CG-O 3.34Å; V338-R340 PolarHBondContact O-N 3.22Å; V338-Q342 HydrophobicContact CG1-CB 4.4Å; V338-I345 HydrophobicContact CG1-CD1 3.87Å; V338-I345 HydrophobicContact CG2-CD1 3.99Å
339	P	95.8	Very high	96.5	Very high	45 Å²	45	48.6 Å²	48.6	29%	0.292	29%	0.291	S	S	.	.			trans	-55.3	142.8	-175.7	-26.5	31.9	0	0	0	112.7	R330 S341 Q342	R330-P339 PolarHBondContact NH1-O 2.86Å; P339-S341 PolarHBondContact O-N 3.16Å; P339-S341 VanDerWaalsContact O-N 3.15Å; P339-Q342 HydrophobicContact CB-CG 4.19Å; P339-Q342 HydrophobicContact CG-CG 4.3Å; P339-Q342 WeakPolarHBondContact O-CB 3.25Å; P339-Q342 PolarHBondContact O-N 3.17Å
340	R	95.9	Very high	96.4	Very high	63 Å²	63	48.6 Å²	48.6	24%	0.238	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.7	179.3	-61.6	-179.9	-178.5	-175.8	3.4	113.5	R242 E283 F285 R330 V338 Q342	R242-R340 PolarHBondContact NH2-O 2.94Å; E283-R340 WeakPolarHBondContact OE2-CD 3.31Å; E283-R340 IonicContact OE2-NH1 3.94Å; F285-R340 HydrophobicContact CE2-CG 4.17Å; F285-R340 HydrophobicContact CZ-CB 4.29Å; F285-R340 HydrophobicContact CZ-CG 4.2Å; R330-R340 HydrophobicContact CB-CG 4.22Å; R330-R340 VanDerWaalsContact O-CG 3.29Å; R330-R340 WeakPolarHBondContact O-CG 3.47Å; R330-R340 PolarHBondContact O-NE 3.38Å; V338-R340 PolarHBondContact O-N 3.22Å; R340-Q342 VanDerWaalsContact C-N 3.28Å; R340-Q342 PolarHBondContact O-N 3.41Å
341	S	96	Very high	96.4	Very high	109 Å²	109	51.8 Å²	51.8	76%	0.762	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.3	176.3	55.8	0	0	0	0	113.5	P339	P339-S341 PolarHBondContact O-N 3.16Å; P339-S341 VanDerWaalsContact O-N 3.15Å
342	Q	96.1	Very high	96.4	Very high	91 Å²	91	51.3 Å²	51.3	43%	0.425	30%	0.303	S	S	.	.	S	Bend	trans	-70.7	151.5	178.2	-72.4	-170	3.2	0	0	111.5	R330 V338 P339 R340	R330-Q342 PolarHBondContact NH1-O 3.38Å; V338-Q342 HydrophobicContact CG1-CB 4.4Å; P339-Q342 HydrophobicContact CB-CG 4.19Å; P339-Q342 HydrophobicContact CG-CG 4.3Å; P339-Q342 WeakPolarHBondContact O-CB 3.25Å; P339-Q342 PolarHBondContact O-N 3.17Å; R340-Q342 VanDerWaalsContact C-N 3.28Å; R340-Q342 PolarHBondContact O-N 3.41Å
343	P	97.5	Very high	96.5	Very high	100 Å²	100	47.8 Å²	47.8	65%	0.649	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-53.4	161.2	172.5	-25.7	35.1	0	0	0	113	R330	R330-P343 PolarHBondContact NH2-O 3.3Å
344	D	98.1	Very high	96.7	Very high	49 Å²	49	45 Å²	45	26%	0.262	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-63	141.3	174.3	-72.1	3.5	0	0	0	110.3	R242	R242-D344 IonicContact CZ-OD1 3.72Å; R242-D344 VanDerWaalsContact N-CG 3.3Å; R242-D344 PolarHBondContact N-OD1 3.15Å; R242-D344 PolarHBondContact N-OD2 3.49Å; R242-D344 IonicContact NH1-OD1 3.92Å; R242-D344 PolarHBondContact NH1-OD1 3.38Å
345	I	98.3	Very high	96.7	Very high	30 Å²	30	45.3 Å²	45.3	15%	0.154	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-104.3	108.6	173.4	-58.2	176.4	0	0	0	106.3	E239 T240 S241 V338 M349	E239-I345 WeakPolarHBondContact CA-O 3.3Å; E239-I345 WeakPolarHBondContact CG-O 3.29Å; T240-I345 HydrophobicContact CG2-CB 4.16Å; T240-I345 HydrophobicContact CG2-CD1 4.02Å; T240-I345 HydrophobicContact CG2-CG1 4.29Å; T240-I345 PolarHBondContact N-O 3.06Å; T240-I345 PolarHBondContact O-N 3.04Å; S241-I345 PolarHBondContact OG-O 2.9Å; V338-I345 HydrophobicContact CG1-CD1 3.87Å; V338-I345 HydrophobicContact CG2-CD1 3.99Å; I345-M349 HydrophobicContact CG2-CB 4.06Å
346	T	97.1	Very high	96.7	Very high	53 Å²	53	43.4 Å²	43.4	33%	0.325	24%	0.24	S	C	.	.			trans	-77	169.5	178.1	66.9	0	0	0	0	111.6	L348 M349 S350	T346-L348 VanDerWaalsContact C-N 3.26Å; T346-L348 PolarHBondContact O-N 3.32Å; T346-M349 HydrophobicContact CG2-SD 4.33Å; T346-M349 PolarHBondContact O-N 2.83Å; T346-M349 WeakPolarHBondContact OG1-CG 3.18Å; T346-M349 PolarHBondContact OG1-N 3.19Å; T346-S350 WeakPolarHBondContact O-CB 3.41Å; T346-S350 PolarHBondContact O-N 3.36Å
347	D	94.8	Very high	96.9	Very high	29 Å²	29	46.3 Å²	46.3	16%	0.155	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-34.6	172.4	62.5	-26.2	0	0	0	113	H392	D347-H392 PolarHBondContact O-NE2 2.93Å; D347-H392 VanDerWaalsContact O-NE2 3.1Å
348	L	95.6	Very high	97.1	Very high	44 Å²	44	48.2 Å²	48.2	23%	0.23	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-27.5	176.2	-60.6	-176.3	0	0	0	113.3	T346 L354 L364 Y365 Y390 H392	T346-L348 VanDerWaalsContact C-N 3.26Å; T346-L348 PolarHBondContact O-N 3.32Å; L348-L354 HydrophobicContact CD2-CD1 4.35Å; L348-L364 HydrophobicContact CD1-CB 4.09Å; L348-L364 HydrophobicContact CD1-CD1 4.03Å; L348-Y365 HydrophobicContact CD2-CD1 4.24Å; L348-Y365 HydrophobicContact CD2-CE1 4.17Å; L348-Y390 HydrophobicContact CD2-CE1 4.08Å; L348-H392 PolarHBondContact O-CE1 3.39Å
349	M	96.6	Very high	97.1	Very high	116 Å²	116	54.4 Å²	54.4	57%	0.571	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-35.6	173.5	-67.9	170.7	73.2	0	0	111.8	I345 T346 K351	I345-M349 HydrophobicContact CG2-CB 4.06Å; T346-M349 HydrophobicContact CG2-SD 4.33Å; T346-M349 PolarHBondContact O-N 2.83Å; T346-M349 WeakPolarHBondContact OG1-CG 3.18Å; T346-M349 PolarHBondContact OG1-N 3.19Å; M349-K351 PolarHBondContact O-N 3.38Å
350	S	96.3	Very high	97.2	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.			trans	-70.6	119.4	174.7	-173.5	0	0	0	0	110.3	L238 E239 T346 T352 H392	L238-S350 VanDerWaalsContact C-OG 3.28Å; L238-S350 WeakPolarHBondContact CA-OG 3.35Å; E239-S350 PolarHBondContact N-OG 2.89Å; T346-S350 WeakPolarHBondContact O-CB 3.41Å; T346-S350 PolarHBondContact O-N 3.36Å; S350-T352 PolarHBondContact O-N 3.4Å; S350-T352 VanDerWaalsContact O-N 3.15Å; S350-T352 WeakPolarHBondContact OG-CG2 3.17Å; S350-T352 PolarHBondContact OG-OG1 3.32Å; S350-H392 PolarHBondContact O-CD2 3.25Å; S350-H392 PolarHBondContact O-NE2 3.3Å
351	K	97.6	Very high	97.2	Very high	69 Å²	69	52.7 Å²	52.7	30%	0.3	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-5	177.3	-66	-170.6	177.3	-170.4	0	114	E228 M349 H392 W393	E228-K351 IonicContact OE1-NZ 3.92Å; E228-K351 PolarHBondContact OE1-NZ 3.24Å; E228-K351 IonicContact OE2-NZ 3.43Å; E228-K351 PolarHBondContact OE2-NZ 3.41Å; M349-K351 PolarHBondContact O-N 3.38Å; K351-H392 WeakPolarHBondContact O-CA 3.46Å; K351-W393 HydrophobicContact CB-CD2 3.78Å; K351-W393 HydrophobicContact CB-CE3 4.16Å; K351-W393 HydrophobicContact CB-CG 4.24Å; K351-W393 HydrophobicContact CB-CH2 4.19Å; K351-W393 HydrophobicContact CB-CZ2 3.85Å; K351-W393 HydrophobicContact CB-CZ3 4.33Å; K351-W393 HydrophobicContact CD-CZ2 3.87Å; K351-W393 HydrophobicContact CG-CZ2 4.46Å; K351-W393 PolarHBondContact O-N 2.86Å
352	T	97.6	Very high	97.2	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.018	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-47.4	-170.2	55.1	0	0	0	0	113.8	M237 V292 S350 W393	M237-T352 HydrophobicContact CB-CG2 4.27Å; M237-T352 HydrophobicContact CG-CG2 3.82Å; M237-T352 WeakPolarHBondContact O-CG2 3.45Å; V292-T352 HydrophobicContact CB-CG2 4.33Å; V292-T352 HydrophobicContact CG2-CG2 3.96Å; S350-T352 PolarHBondContact O-N 3.4Å; S350-T352 VanDerWaalsContact O-N 3.15Å; S350-T352 WeakPolarHBondContact OG-CG2 3.17Å; S350-T352 PolarHBondContact OG-OG1 3.32Å; T352-W393 HydrophobicContact CG2-CZ3 4.44Å
353	R	98.3	Very high	97.2	Very high	3 Å²	3	57.2 Å²	57.2	1%	0.011	28%	0.283	C	S	.	.			trans	-147.9	120.8	-176	-162.2	75.9	67.8	-160.6	-15	112.2	N211 D216 Y290 V355 H392 F394 N396	N211-R353 PolarHBondContact O-NH2 3.11Å; D216-R353 VanDerWaalsContact CB-NH1 3.3Å; D216-R353 WeakPolarHBondContact OD1-CD 3.49Å; D216-R353 IonicContact OD1-CZ 2.58Å; D216-R353 IonicContact OD1-NE 3.27Å; D216-R353 PolarHBondContact OD1-NE 3.19Å; D216-R353 IonicContact OD1-NH1 3.93Å; D216-R353 PolarHBondContact OD1-NH1 3.16Å; D216-R353 IonicContact OD2-CZ 2.68Å; D216-R353 IonicContact OD2-NE 3.98Å; D216-R353 IonicContact OD2-NH1 3.54Å; D216-R353 PolarHBondContact OD2-NH1 3.27Å; D216-R353 IonicContact OD2-NH2 3.04Å; D216-R353 PolarHBondContact OD2-NH2 3.28Å; Y290-R353 HydrophobicContact CD2-CB 3.84Å; Y290-R353 HydrophobicContact CD2-CG 3.79Å; Y290-R353 HydrophobicContact CE2-CG 4.02Å; Y290-R353 HydrophobicContact CG-CB 4.22Å; Y290-R353 HydrophobicContact CG-CG 4.34Å; R353-V355 HydrophobicContact CB-CG2 4.36Å; R353-V355 HydrophobicContact CG-CG2 3.68Å; R353-H392 VanDerWaalsContact C-CD2 3.41Å; R353-F394 CarbonylContact C-O 3.49Å; R353-F394 WeakPolarHBondContact CA-O 3.45Å; R353-N396 HydrophobicContact CG-CB 3.87Å
354	L	98.2	Very high	97.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	120.3	167	-172.1	52.8	0	0	0	109.9	L219 L348 W386 L387 Y390 H392 F394 A395 N396	L219-L354 HydrophobicContact CD1-CB 4.49Å; L219-L354 HydrophobicContact CD1-CD2 4.35Å; L348-L354 HydrophobicContact CD2-CD1 4.35Å; L354-W386 HydrophobicContact CD1-CH2 3.8Å; L354-W386 HydrophobicContact CD1-CZ2 4.43Å; L354-W386 HydrophobicContact CD2-CE3 4.36Å; L354-W386 HydrophobicContact CD2-CH2 3.62Å; L354-W386 HydrophobicContact CD2-CZ2 4.36Å; L354-W386 HydrophobicContact CD2-CZ3 3.61Å; L354-W386 HydrophobicContact CG-CH2 3.88Å; L354-W386 HydrophobicContact CG-CZ3 4.12Å; L354-L387 HydrophobicContact CD2-CD2 3.94Å; L354-Y390 HydrophobicContact CD1-CD1 3.53Å; L354-Y390 HydrophobicContact CD1-CE1 3.56Å; L354-Y390 HydrophobicContact CD1-CG 4.48Å; L354-Y390 HydrophobicContact CD2-CD1 3.74Å; L354-Y390 HydrophobicContact CD2-CG 4.07Å; L354-Y390 HydrophobicContact CG-CD1 4.28Å; L354-H392 HydrophobicContact CB-CB 3.77Å; L354-H392 PolarHBondContact N-CD2 3.37Å; L354-F394 PolarHBondContact N-O 3.45Å; L354-A395 HydrophobicContact CB-CB 4.23Å; L354-A395 CarbonylContact O-C 3.55Å; L354-A395 VanDerWaalsContact O-CA 3.31Å; L354-A395 WeakPolarHBondContact O-CA 3.35Å; L354-N396 PolarHBondContact O-N 3.32Å
355	V	98.1	Very high	96.9	Very high	14 Å²	14	54.6 Å²	54.6	9%	0.085	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.6	177.1	-171.1	0	0	0	0	108.5	R353 V376 N396	R353-V355 HydrophobicContact CB-CG2 4.36Å; R353-V355 HydrophobicContact CG-CG2 3.68Å; V355-V376 HydrophobicContact CG1-CG1 3.68Å; V355-V376 HydrophobicContact CG1-CG2 4.45Å; V355-N396 HydrophobicContact CG2-CB 4.05Å
356	K	97.9	Very high	96.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.274	C	S	.	.			trans	-102	125.9	171.1	-69.7	177	66.4	176.8	0	110.6	Y365 P366 P367 V376 C377 F379 E383 W386	K356-Y365 HydrophobicContact CB-CD2 4.05Å; K356-Y365 HydrophobicContact CB-CE2 3.69Å; K356-Y365 HydrophobicContact CD-CD2 4.02Å; K356-Y365 HydrophobicContact CD-CG 4.32Å; K356-Y365 VanDerWaalsContact CE-CD2 3.49Å; K356-Y365 HydrophobicContact CG-CD1 4.25Å; K356-Y365 HydrophobicContact CG-CD2 3.61Å; K356-Y365 HydrophobicContact CG-CE1 4.37Å; K356-Y365 HydrophobicContact CG-CE2 3.73Å; K356-Y365 HydrophobicContact CG-CG 3.87Å; K356-P366 WeakPolarHBondContact CE-O 3.5Å; K356-P366 PolarHBondContact NZ-O 2.85Å; K356-P367 PolarHBondContact NZ-O 3.37Å; K356-V376 WeakPolarHBondContact O-CA 3.47Å; K356-C377 HydrophobicContact CB-CB 3.71Å; K356-C377 PolarHBondContact O-N 3.41Å; K356-F379 HydrophobicContact CB-CE1 4.31Å; K356-F379 HydrophobicContact CD-CD1 4.34Å; K356-F379 HydrophobicContact CD-CE1 3.68Å; K356-F379 HydrophobicContact CG-CE1 3.92Å; K356-E383 WeakPolarHBondContact CD-OE1 3.4Å; K356-E383 IonicContact NZ-OE1 3.68Å; K356-E383 PolarHBondContact NZ-OE1 2.69Å; K356-W386 HydrophobicContact CD-CH2 3.69Å; K356-W386 HydrophobicContact CD-CZ3 3.62Å; K356-W386 HydrophobicContact CG-CH2 3.83Å; K356-W386 HydrophobicContact CG-CZ3 4.12Å
357	W	98	Very high	96.8	Very high	82 Å²	82	56.9 Å²	56.9	31%	0.311	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-101.9	126.3	175.5	-64.5	94.3	0	0	0	109	Y359 L360 E361 Y365 S375 V376	W357-Y359 HydrophobicContact CB-CD1 4.41Å; W357-Y359 HydrophobicContact CB-CD2 4.46Å; W357-Y359 HydrophobicContact CB-CE1 3.95Å; W357-Y359 HydrophobicContact CB-CE2 3.97Å; W357-Y359 HydrophobicContact CD2-CE1 4.25Å; W357-Y359 AromaticContact CD2-CZ 3.93Å; W357-Y359 VanDerWaalsContact CD2-OH 3.3Å; W357-Y359 AromaticContact CE3-CE1 3.69Å; W357-Y359 HydrophobicContact CE3-CE1 3.69Å; W357-Y359 AromaticContact CE3-CZ 3.78Å; W357-Y359 VanDerWaalsContact CE3-OH 3.24Å; W357-Y359 HydrophobicContact CG-CE1 4.41Å; W357-Y359 HydrophobicContact CG-CE2 4.46Å; W357-Y359 AromaticContact CG-CZ 3.93Å; W357-Y359 PolarHBondContact O-N 3.48Å; W357-L360 HydrophobicContact CB-CB 4.49Å; W357-L360 HydrophobicContact CB-CD1 4.15Å; W357-L360 HydrophobicContact CB-CG 4.32Å; W357-L360 PolarHBondContact O-N 3.34Å; W357-E361 PolarHBondContact O-N 3Å; W357-Y365 WeakPolarHBondContact CB-OH 3.3Å; W357-Y365 PolarHBondContact N-OH 3.15Å; W357-S375 CarbonylContact C-O 3.54Å; W357-S375 VanDerWaalsContact CA-O 3.31Å; W357-S375 WeakPolarHBondContact CA-O 3.48Å; W357-V376 HydrophobicContact CD2-CG2 4.45Å; W357-V376 HydrophobicContact CE3-CG2 3.92Å; W357-V376 HydrophobicContact CH2-CG2 4.01Å; W357-V376 HydrophobicContact CZ2-CG2 4.49Å; W357-V376 HydrophobicContact CZ3-CG2 3.69Å
358	Q	98.3	Very high	96.9	Very high	100 Å²	100	56.5 Å²	56.5	47%	0.467	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-49.7	-39.6	-175.6	-172.5	179.1	10.6	0	0	113.2	L360 H372 S375	Q358-L360 VanDerWaalsContact C-N 3.27Å; Q358-L360 PolarHBondContact O-N 2.91Å; Q358-H372 VanDerWaalsContact CB-CD2 3.5Å; Q358-H372 WeakPolarHBondContact CB-CD2 3.41Å; Q358-S375 PolarHBondContact N-O 3.13Å
359	Y	97.3	Very high	97	Very high	142 Å²	142	55.7 Å²	55.7	56%	0.557	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-79.4	-2.9	-177.1	53.6	-99.5	0	0	0	114.3	W357	W357-Y359 HydrophobicContact CB-CD1 4.41Å; W357-Y359 HydrophobicContact CB-CD2 4.46Å; W357-Y359 HydrophobicContact CB-CE1 3.95Å; W357-Y359 HydrophobicContact CB-CE2 3.97Å; W357-Y359 HydrophobicContact CD2-CE1 4.25Å; W357-Y359 AromaticContact CD2-CZ 3.93Å; W357-Y359 VanDerWaalsContact CD2-OH 3.3Å; W357-Y359 AromaticContact CE3-CE1 3.69Å; W357-Y359 HydrophobicContact CE3-CE1 3.69Å; W357-Y359 AromaticContact CE3-CZ 3.78Å; W357-Y359 VanDerWaalsContact CE3-OH 3.24Å; W357-Y359 HydrophobicContact CG-CE1 4.41Å; W357-Y359 HydrophobicContact CG-CE2 4.46Å; W357-Y359 AromaticContact CG-CZ 3.93Å; W357-Y359 PolarHBondContact O-N 3.48Å
360	L	97.4	Very high	96.9	Very high	49 Å²	49	51.2 Å²	51.2	26%	0.257	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-115.6	-3.3	176.4	-59.8	175.4	0	0	0	112.7	W357 Q358 N363 L364 Y365	W357-L360 HydrophobicContact CB-CB 4.49Å; W357-L360 HydrophobicContact CB-CD1 4.15Å; W357-L360 HydrophobicContact CB-CG 4.32Å; W357-L360 PolarHBondContact O-N 3.34Å; Q358-L360 VanDerWaalsContact C-N 3.27Å; Q358-L360 PolarHBondContact O-N 2.91Å; L360-N363 PolarHBondContact O-N 3.24Å; L360-L364 HydrophobicContact CB-CD1 4.07Å; L360-L364 HydrophobicContact CB-CG 4.33Å; L360-L364 HydrophobicContact CD1-CD1 3.85Å; L360-L364 HydrophobicContact CD2-CD1 4.22Å; L360-L364 HydrophobicContact CG-CD1 4.24Å; L360-L364 PolarHBondContact O-N 3.22Å; L360-Y365 HydrophobicContact CB-CE2 4.1Å; L360-Y365 WeakPolarHBondContact CB-OH 3.43Å
361	E	96.8	Very high	96.9	Very high	23 Å²	23	55.7 Å²	55.7	11%	0.107	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-60.6	149.7	172.8	-69.2	175.1	-160	0	0	110.4	W357 N363 Y365 C368 H372	W357-E361 PolarHBondContact O-N 3Å; E361-N363 PolarHBondContact O-N 3.39Å; E361-Y365 HydrophobicContact CG-CD2 3.9Å; E361-Y365 HydrophobicContact CG-CE2 3.73Å; E361-C368 WeakPolarHBondContact OE1-CB 3.32Å; E361-C368 WeakPolarHBondContact OE2-CB 3.24Å; E361-C368 PolarHBondContact OE2-N 3.1Å; E361-H372 VanDerWaalsContact CD-NE2 3.29Å; E361-H372 IonicContact OE1-CD2 2.67Å; E361-H372 IonicContact OE1-CE1 3.09Å; E361-H372 IonicContact OE1-NE2 2.69Å; E361-H372 PolarHBondContact OE1-NE2 3.37Å; E361-H372 IonicContact OE2-CE1 3.34Å; E361-H372 IonicContact OE2-NE2 3.93Å; E361-H372 PolarHBondContact OE2-NE2 3.16Å
362	E	95.4	Very high	96.9	Very high	160 Å²	160	55.5 Å²	55.5	75%	0.748	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	-14.9	-172.8	-54.6	-177.1	129.5	0	0	115.2	Y365 P367	E362-Y365 PolarHBondContact N-O 3.5Å; E362-P367 HydrophobicContact CG-CG 3.73Å
363	N	95.8	Very high	96.9	Very high	136 Å²	136	58 Å²	58	73%	0.727	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-53.8	174.6	-64.6	-48.2	0	0	0	112.2	L360 E361	L360-N363 PolarHBondContact O-N 3.24Å; E361-N363 PolarHBondContact O-N 3.39Å
364	L	95.1	Very high	96.7	Very high	85 Å²	85	63.6 Å²	63.6	45%	0.445	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-25.2	-176.4	-59.9	-175.9	0	0	0	113.4	L348 L360	L348-L364 HydrophobicContact CD1-CB 4.09Å; L348-L364 HydrophobicContact CD1-CD1 4.03Å; L360-L364 HydrophobicContact CB-CD1 4.07Å; L360-L364 HydrophobicContact CB-CG 4.33Å; L360-L364 HydrophobicContact CD1-CD1 3.85Å; L360-L364 HydrophobicContact CD2-CD1 4.22Å; L360-L364 HydrophobicContact CG-CD1 4.24Å; L360-L364 PolarHBondContact O-N 3.22Å
365	Y	95.6	Very high	96.6	Very high	8 Å²	8	65.8 Å²	65.8	3%	0.031	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-155.1	162.4	-179.3	30.4	-108.5	0	0	0	110.7	L348 K356 W357 L360 E361 E362 W386	L348-Y365 HydrophobicContact CD2-CD1 4.24Å; L348-Y365 HydrophobicContact CD2-CE1 4.17Å; K356-Y365 HydrophobicContact CB-CD2 4.05Å; K356-Y365 HydrophobicContact CB-CE2 3.69Å; K356-Y365 HydrophobicContact CD-CD2 4.02Å; K356-Y365 HydrophobicContact CD-CG 4.32Å; K356-Y365 VanDerWaalsContact CE-CD2 3.49Å; K356-Y365 HydrophobicContact CG-CD1 4.25Å; K356-Y365 HydrophobicContact CG-CD2 3.61Å; K356-Y365 HydrophobicContact CG-CE1 4.37Å; K356-Y365 HydrophobicContact CG-CE2 3.73Å; K356-Y365 HydrophobicContact CG-CG 3.87Å; W357-Y365 WeakPolarHBondContact CB-OH 3.3Å; W357-Y365 PolarHBondContact N-OH 3.15Å; L360-Y365 HydrophobicContact CB-CE2 4.1Å; L360-Y365 WeakPolarHBondContact CB-OH 3.43Å; E361-Y365 HydrophobicContact CG-CD2 3.9Å; E361-Y365 HydrophobicContact CG-CE2 3.73Å; E362-Y365 PolarHBondContact N-O 3.5Å; Y365-W386 HydrophobicContact CG-CH2 4.5Å; Y365-W386 HydrophobicContact CG-CZ2 4.4Å
366	P	95.2	Very high	96.6	Very high	63 Å²	63	65.5 Å²	65.5	41%	0.409	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-55.3	166.5	178.2	-25.3	34.9	0	0	0	113.1	K356	K356-P366 WeakPolarHBondContact CE-O 3.5Å; K356-P366 PolarHBondContact NZ-O 2.85Å
367	P	96.9	Very high	96.7	Very high	69 Å²	69	65.5 Å²	65.5	45%	0.448	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-58.5	150.6	170.5	-24.1	33.6	0	0	0	113.4	K356 E362	K356-P367 PolarHBondContact NZ-O 3.37Å; E362-P367 HydrophobicContact CG-CG 3.73Å
368	C	97.7	Very high	96.7	Very high	20 Å²	20	61.9 Å²	61.9	14%	0.135	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-65.4	132.8	171.6	-174.5	0	0	0	0	110.5	E361 H372 C377	E361-C368 WeakPolarHBondContact OE1-CB 3.32Å; E361-C368 WeakPolarHBondContact OE2-CB 3.24Å; E361-C368 PolarHBondContact OE2-N 3.1Å; C368-H372 WeakPolarHBondContact CB-NE2 3.49Å; C368-C377 HydrophobicContact CB-CB 3.72Å; C368-C377 WeakPolarHBondContact CB-SG 3.47Å; C368-C377 WeakPolarHBondContact SG-CB 3.49Å; C368-C377 CovalentContact SG-SG 2.03Å; C368-C377 PolarHBondContact SG-SG 2.7Å
369	S	96.2	Very high	96.7	Very high	27 Å²	27	57.2 Å²	57.2	19%	0.189	30%	0.296	C	S	.	.	S	Bend	trans	-91.4	-16.6	177.7	72.4	0	0	0	0	113.4	R77 G380 E383	R77-S369 PolarHBondContact NH1-O 2.95Å; R77-S369 PolarHBondContact NH2-O 3.23Å; S369-G380 WeakPolarHBondContact OG-CA 3.49Å; S369-G380 PolarHBondContact OG-N 3.05Å; S369-G380 PolarHBondContact OG-O 3.01Å; S369-E383 WeakPolarHBondContact CB-OE2 3.36Å; S369-E383 PolarHBondContact N-OE2 3.38Å; S369-E383 WeakPolarHBondContact OG-CG 3.31Å; S369-E383 PolarHBondContact OG-OE2 3.14Å
370	G	95.4	Very high	96.7	Very high	22 Å²	22	50.4 Å²	50.4	23%	0.227	27%	0.27	C	S	.	.	S	Bend	trans	-93.6	-118.1	175.3	0	0	0	0	0	112.4	I378	G370-I378 VanDerWaalsContact CA-O 3.28Å; G370-I378 WeakPolarHBondContact CA-O 2.98Å
371	Q	95.9	Very high	96.6	Very high	94 Å²	94	48.1 Å²	48.1	44%	0.439	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.1	-179.3	72.2	179.3	13.5	0	0	112.2	I378 V402	Q371-I378 HydrophobicContact CG-CB 4.29Å; Q371-I378 HydrophobicContact CG-CD1 4.21Å; Q371-I378 PolarHBondContact N-O 3.4Å; Q371-I378 VanDerWaalsContact N-O 3.16Å; Q371-I378 PolarHBondContact O-N 2.71Å; Q371-V402 HydrophobicContact CB-CG1 4.49Å; Q371-V402 VanDerWaalsContact CD-CG2 3.41Å; Q371-V402 HydrophobicContact CG-CB 4.44Å; Q371-V402 HydrophobicContact CG-CG1 3.86Å; Q371-V402 HydrophobicContact CG-CG2 3.66Å
372	H	98.1	Very high	96.6	Very high	65 Å²	65	49 Å²	49	30%	0.301	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.5	176.2	-57.4	90.3	0	0	0	112.1	Q358 E361 C368 V376	Q358-H372 VanDerWaalsContact CB-CD2 3.5Å; Q358-H372 WeakPolarHBondContact CB-CD2 3.41Å; E361-H372 VanDerWaalsContact CD-NE2 3.29Å; E361-H372 IonicContact OE1-CD2 2.67Å; E361-H372 IonicContact OE1-CE1 3.09Å; E361-H372 IonicContact OE1-NE2 2.69Å; E361-H372 PolarHBondContact OE1-NE2 3.37Å; E361-H372 IonicContact OE2-CE1 3.34Å; E361-H372 IonicContact OE2-NE2 3.93Å; E361-H372 PolarHBondContact OE2-NE2 3.16Å; C368-H372 WeakPolarHBondContact CB-NE2 3.49Å; H372-V376 WeakPolarHBondContact CA-O 3.48Å
373	V	96.9	Very high	96.6	Very high	57 Å²	57	41.9 Å²	41.9	35%	0.345	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	117.5	168.6	176.2	0	0	0	0	108.4	S375 V376 I378	V373-S375 VanDerWaalsContact C-N 3.29Å; V373-S375 PolarHBondContact O-N 3.29Å; V373-V376 PolarHBondContact N-O 3Å; V373-V376 PolarHBondContact O-N 2.64Å; V373-I378 HydrophobicContact CB-CD1 4.18Å; V373-I378 HydrophobicContact CG2-CD1 3.59Å; V373-I378 HydrophobicContact CG2-CG1 4.4Å
374	R	94.1	Very high	96.8	Very high	119 Å²	119	35.4 Å²	35.4	45%	0.449	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	46.8	-175	-58.8	178.1	-70.3	177.4	-4.1	111.8	Y264 V376	Y264-R374 WeakPolarHBondContact OH-CD 3.27Å; R374-V376 PolarHBondContact O-N 3.39Å; R374-V376 VanDerWaalsContact O-N 3.11Å
375	S	97.1	Very high	96.9	Very high	46 Å²	46	34.3 Å²	34.3	32%	0.322	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	6.6	-178.4	-51.7	0	0	0	0	116.1	W357 Q358 V373	W357-S375 CarbonylContact C-O 3.54Å; W357-S375 VanDerWaalsContact CA-O 3.31Å; W357-S375 WeakPolarHBondContact CA-O 3.48Å; Q358-S375 PolarHBondContact N-O 3.13Å; V373-S375 VanDerWaalsContact C-N 3.29Å; V373-S375 PolarHBondContact O-N 3.29Å
376	V	98.2	Very high	96.9	Very high	9 Å²	9	36.1 Å²	36.1	6%	0.055	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.6	173.1	-179.8	0	0	0	0	109.6	V355 K356 W357 H372 V373 R374 I378 K397	V355-V376 HydrophobicContact CG1-CG1 3.68Å; V355-V376 HydrophobicContact CG1-CG2 4.45Å; K356-V376 WeakPolarHBondContact O-CA 3.47Å; W357-V376 HydrophobicContact CD2-CG2 4.45Å; W357-V376 HydrophobicContact CE3-CG2 3.92Å; W357-V376 HydrophobicContact CH2-CG2 4.01Å; W357-V376 HydrophobicContact CZ2-CG2 4.49Å; W357-V376 HydrophobicContact CZ3-CG2 3.69Å; H372-V376 WeakPolarHBondContact CA-O 3.48Å; V373-V376 PolarHBondContact N-O 3Å; V373-V376 PolarHBondContact O-N 2.64Å; R374-V376 PolarHBondContact O-N 3.39Å; R374-V376 VanDerWaalsContact O-N 3.11Å; V376-I378 PolarHBondContact O-N 3.28Å; V376-K397 HydrophobicContact CB-CD 4.5Å; V376-K397 HydrophobicContact CG1-CD 4Å; V376-K397 HydrophobicContact CG1-CG 4.1Å
377	C	98.6	Very high	97.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	128.4	173.2	177.7	0	0	0	0	110.7	K356 C368 K397	K356-C377 HydrophobicContact CB-CB 3.71Å; K356-C377 PolarHBondContact O-N 3.41Å; C368-C377 HydrophobicContact CB-CB 3.72Å; C368-C377 WeakPolarHBondContact CB-SG 3.47Å; C368-C377 WeakPolarHBondContact SG-CB 3.49Å; C368-C377 CovalentContact SG-SG 2.03Å; C368-C377 PolarHBondContact SG-SG 2.7Å; C377-K397 PolarHBondContact O-N 2.86Å
378	I	98.2	Very high	97.1	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.026	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	112	157.8	-54.5	177.5	0	0	0	105.7	G370 Q371 V373 V376 K397 D399 V402	G370-I378 VanDerWaalsContact CA-O 3.28Å; G370-I378 WeakPolarHBondContact CA-O 2.98Å; Q371-I378 HydrophobicContact CG-CB 4.29Å; Q371-I378 HydrophobicContact CG-CD1 4.21Å; Q371-I378 PolarHBondContact N-O 3.4Å; Q371-I378 VanDerWaalsContact N-O 3.16Å; Q371-I378 PolarHBondContact O-N 2.71Å; V373-I378 HydrophobicContact CB-CD1 4.18Å; V373-I378 HydrophobicContact CG2-CD1 3.59Å; V373-I378 HydrophobicContact CG2-CG1 4.4Å; V376-I378 PolarHBondContact O-N 3.28Å; I378-K397 WeakPolarHBondContact CA-O 3.3Å; I378-K397 HydrophobicContact CG1-CB 4.07Å; I378-D399 HydrophobicContact CD1-CB 4.33Å; I378-D399 HydrophobicContact CG2-CB 3.7Å; I378-V402 HydrophobicContact CB-CB 4.44Å; I378-V402 HydrophobicContact CB-CG1 4.21Å; I378-V402 HydrophobicContact CB-CG2 4.15Å; I378-V402 HydrophobicContact CD1-CG2 3.98Å; I378-V402 HydrophobicContact CG2-CB 3.73Å; I378-V402 HydrophobicContact CG2-CG1 3.89Å; I378-V402 HydrophobicContact CG2-CG2 3.7Å
379	F	98.4	Very high	97	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.009	18%	0.178	C	C	.	.			trans	-63.2	150.2	-168.8	-59.2	-71.6	0	0	0	112.7	K356 E383 W386 L387 A395 N396 K397 F398 L406	K356-F379 HydrophobicContact CB-CE1 4.31Å; K356-F379 HydrophobicContact CD-CD1 4.34Å; K356-F379 HydrophobicContact CD-CE1 3.68Å; K356-F379 HydrophobicContact CG-CE1 3.92Å; F379-E383 WeakPolarHBondContact CD1-OE1 3.34Å; F379-W386 HydrophobicContact CE1-CZ3 4.18Å; F379-L387 HydrophobicContact CB-CD1 4.18Å; F379-L387 HydrophobicContact CD1-CD1 4.38Å; F379-L387 HydrophobicContact CD1-CD2 4Å; F379-L387 HydrophobicContact CD2-CD1 4.48Å; F379-L387 HydrophobicContact CD2-CD2 4.34Å; F379-L387 HydrophobicContact CE1-CD2 3.8Å; F379-L387 HydrophobicContact CE2-CD2 4.18Å; F379-L387 HydrophobicContact CG-CD1 4.12Å; F379-L387 HydrophobicContact CG-CD2 4.26Å; F379-L387 HydrophobicContact CZ-CD2 3.92Å; F379-A395 HydrophobicContact CD2-CB 4.4Å; F379-A395 HydrophobicContact CE2-CB 3.69Å; F379-A395 HydrophobicContact CZ-CB 4.24Å; F379-N396 WeakPolarHBondContact CE2-O 3.04Å; F379-N396 WeakPolarHBondContact CZ-O 3.44Å; F379-K397 WeakPolarHBondContact CD2-O 3.44Å; F379-K397 PolarHBondContact N-O 3.38Å; F379-F398 HydrophobicContact CB-CE1 4.23Å; F379-F398 HydrophobicContact CD2-CD1 4.38Å; F379-F398 AromaticContact CD2-CE1 3.92Å; F379-F398 HydrophobicContact CD2-CE1 3.92Å; F379-F398 HydrophobicContact CD2-CE2 4.1Å; F379-F398 AromaticContact CD2-CZ 3.78Å; F379-F398 HydrophobicContact CD2-CZ 3.78Å; F379-F398 HydrophobicContact CE2-CE2 4.38Å; F379-F398 HydrophobicContact CE2-CZ 4.3Å; F379-F398 HydrophobicContact CG-CE1 4.48Å; F379-L406 HydrophobicContact CB-CD2 3.33Å; F379-L406 WeakPolarHBondContact O-CD2 3.5Å
380	G	96.9	Very high	97	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.			trans	-114.5	168.8	172.2	0	0	0	0	0	113.3	S369 A382 E383 D403 L406	S369-G380 WeakPolarHBondContact OG-CA 3.49Å; S369-G380 PolarHBondContact OG-N 3.05Å; S369-G380 PolarHBondContact OG-O 3.01Å; G380-A382 PolarHBondContact O-N 3.34Å; G380-A382 VanDerWaalsContact O-N 3.13Å; G380-E383 PolarHBondContact N-OE2 3.16Å; G380-E383 WeakPolarHBondContact O-CB 3.34Å; G380-E383 PolarHBondContact O-N 2.93Å; G380-D403 WeakPolarHBondContact CA-OD2 3.37Å; G380-L406 WeakPolarHBondContact O-CD2 3.38Å
381	A	96.8	Very high	97.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-59	-29.5	-172	0	0	0	0	0	114	I62 E383 L384 D403 I405 L406	I62-A381 HydrophobicContact CG2-CB 4.22Å; I62-A381 VanDerWaalsContact CG2-O 3.24Å; I62-A381 WeakPolarHBondContact CG2-O 3.03Å; A381-E383 PolarHBondContact O-N 3.33Å; A381-L384 WeakPolarHBondContact O-CB 3.42Å; A381-L384 PolarHBondContact O-N 3.06Å; A381-L384 VanDerWaalsContact O-N 3.16Å; A381-D403 PolarHBondContact N-OD2 2.05Å; A381-I405 HydrophobicContact CB-CB 4.13Å; A381-I405 HydrophobicContact CB-CG2 4Å; A381-L406 HydrophobicContact CB-CB 4.4Å
382	A	96.3	Very high	97.2	Very high	43 Å²	43	31.9 Å²	31.9	36%	0.355	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-67.4	-13.9	178.4	0	0	0	0	0	113.4	V70 G380	V70-A382 HydrophobicContact CG1-CB 3.99Å; G380-A382 PolarHBondContact O-N 3.34Å; G380-A382 VanDerWaalsContact O-N 3.13Å
383	E	96.3	Very high	97.2	Very high	9 Å²	9	28.9 Å²	28.9	4%	0.042	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-89.1	-3.7	176.7	-71.5	166.2	107.4	0	0	113.2	K356 S369 F379 G380 A381 H385 W386 L387	K356-E383 WeakPolarHBondContact CD-OE1 3.4Å; K356-E383 IonicContact NZ-OE1 3.68Å; K356-E383 PolarHBondContact NZ-OE1 2.69Å; S369-E383 WeakPolarHBondContact CB-OE2 3.36Å; S369-E383 PolarHBondContact N-OE2 3.38Å; S369-E383 WeakPolarHBondContact OG-CG 3.31Å; S369-E383 PolarHBondContact OG-OE2 3.14Å; F379-E383 WeakPolarHBondContact CD1-OE1 3.34Å; G380-E383 PolarHBondContact N-OE2 3.16Å; G380-E383 WeakPolarHBondContact O-CB 3.34Å; G380-E383 PolarHBondContact O-N 2.93Å; A381-E383 PolarHBondContact O-N 3.33Å; E383-H385 VanDerWaalsContact C-N 3.34Å; E383-H385 PolarHBondContact O-N 3.09Å; E383-W386 PolarHBondContact O-N 3.34Å; E383-W386 VanDerWaalsContact O-N 3.11Å; E383-L387 HydrophobicContact CB-CD1 4.12Å; E383-L387 HydrophobicContact CB-CG 4.21Å; E383-L387 WeakPolarHBondContact O-CB 3.25Å; E383-L387 VanDerWaalsContact O-CG 3.3Å; E383-L387 WeakPolarHBondContact O-CG 3.44Å; E383-L387 PolarHBondContact O-N 3.15Å
384	L	97.9	Very high	97.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-53.2	-47.7	-174.7	179.6	65.5	0	0	0	113	I62 Y63 A381 L388 L406 C409 L410	I62-L384 HydrophobicContact CB-CD2 4.21Å; I62-L384 HydrophobicContact CG2-CB 4.06Å; I62-L384 HydrophobicContact CG2-CD2 3.72Å; Y63-L384 HydrophobicContact CD2-CG 4.37Å; A381-L384 WeakPolarHBondContact O-CB 3.42Å; A381-L384 PolarHBondContact O-N 3.06Å; A381-L384 VanDerWaalsContact O-N 3.16Å; L384-L388 HydrophobicContact CD1-CD1 3.83Å; L384-L388 HydrophobicContact CD1-CG 4.27Å; L384-L388 HydrophobicContact CG-CD1 4.24Å; L384-L388 WeakPolarHBondContact O-CG 2.92Å; L384-L388 PolarHBondContact O-N 2.69Å; L384-L388 VanDerWaalsContact O-N 3.16Å; L384-L406 HydrophobicContact CB-CD1 4Å; L384-L406 HydrophobicContact CD1-CD1 4.06Å; L384-C409 HydrophobicContact CD1-CB 4.35Å; L384-C409 HydrophobicContact CD2-CB 3.55Å; L384-L410 HydrophobicContact CD1-CD2 3.61Å; L384-L410 HydrophobicContact CD1-CG 3.77Å
385	H	97.4	Very high	97.5	Very high	62 Å²	62	20.5 Å²	20.5	29%	0.287	11%	0.114	S	C	.	.	H	α-helix	trans	-60.2	-48.5	179.1	-174.5	88.4	0	0	0	111.4	Y63 M65 E383 N389	Y63-H385 AromaticContact CE1-ND1 3.88Å; Y63-H385 AromaticContact CE2-ND1 3.98Å; Y63-H385 AromaticContact CZ-ND1 3.74Å; Y63-H385 WeakPolarHBondContact O-CB 3.39Å; Y63-H385 PolarHBondContact O-ND1 2.95Å; M65-H385 HydrophobicContact CG-CB 3.97Å; M65-H385 HydrophobicContact SD-CB 4.07Å; E383-H385 VanDerWaalsContact C-N 3.34Å; E383-H385 PolarHBondContact O-N 3.09Å; H385-N389 WeakPolarHBondContact O-CB 3.17Å; H385-N389 PolarHBondContact O-N 3.45Å; H385-N389 PolarHBondContact O-ND2 3.3Å
386	W	97.3	Very high	97.6	Very high	47 Å²	47	18.6 Å²	18.6	18%	0.178	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-48	-178.6	178.1	79.1	0	0	0	111.2	L354 K356 Y365 F379 E383 L388 N389 Y390	L354-W386 HydrophobicContact CD1-CH2 3.8Å; L354-W386 HydrophobicContact CD1-CZ2 4.43Å; L354-W386 HydrophobicContact CD2-CE3 4.36Å; L354-W386 HydrophobicContact CD2-CH2 3.62Å; L354-W386 HydrophobicContact CD2-CZ2 4.36Å; L354-W386 HydrophobicContact CD2-CZ3 3.61Å; L354-W386 HydrophobicContact CG-CH2 3.88Å; L354-W386 HydrophobicContact CG-CZ3 4.12Å; K356-W386 HydrophobicContact CD-CH2 3.69Å; K356-W386 HydrophobicContact CD-CZ3 3.62Å; K356-W386 HydrophobicContact CG-CH2 3.83Å; K356-W386 HydrophobicContact CG-CZ3 4.12Å; Y365-W386 HydrophobicContact CG-CH2 4.5Å; Y365-W386 HydrophobicContact CG-CZ2 4.4Å; F379-W386 HydrophobicContact CE1-CZ3 4.18Å; E383-W386 PolarHBondContact O-N 3.34Å; E383-W386 VanDerWaalsContact O-N 3.11Å; W386-L388 VanDerWaalsContact C-N 3.35Å; W386-L388 PolarHBondContact O-N 3.38Å; W386-N389 PolarHBondContact O-N 3.36Å; W386-N389 VanDerWaalsContact O-N 3.15Å; W386-Y390 HydrophobicContact CD2-CD2 4.41Å; W386-Y390 AromaticContact CE2-CD2 3.42Å; W386-Y390 VanDerWaalsContact CE2-CD2 3.42Å; W386-Y390 AromaticContact CE2-CE2 3.82Å; W386-Y390 AromaticContact CE2-CG 3.97Å; W386-Y390 HydrophobicContact CZ2-CD1 4.24Å; W386-Y390 AromaticContact CZ2-CD2 3.49Å; W386-Y390 HydrophobicContact CZ2-CD2 3.49Å; W386-Y390 VanDerWaalsContact CZ2-CD2 3.49Å; W386-Y390 HydrophobicContact CZ2-CE1 4.32Å; W386-Y390 AromaticContact CZ2-CE2 3.55Å; W386-Y390 HydrophobicContact CZ2-CE2 3.55Å; W386-Y390 AromaticContact CZ2-CG 3.85Å; W386-Y390 HydrophobicContact CZ2-CG 3.85Å; W386-Y390 AromaticContact CZ2-CZ 3.99Å; W386-Y390 AromaticContact NE1-CD2 3.23Å; W386-Y390 AromaticContact NE1-CE2 3.63Å; W386-Y390 WeakPolarHBondContact O-CB 3.4Å; W386-Y390 PolarHBondContact O-N 3.24Å
387	L	98	Very high	97.6	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-54.6	-47.8	179.2	-74	171.6	0	0	0	112.2	L219 L354 F379 E383 N389 A395 F398 L406	L219-L387 WeakPolarHBondContact CD1-O 3.05Å; L219-L387 HydrophobicContact CD2-CB 3.9Å; L354-L387 HydrophobicContact CD2-CD2 3.94Å; F379-L387 HydrophobicContact CB-CD1 4.18Å; F379-L387 HydrophobicContact CD1-CD1 4.38Å; F379-L387 HydrophobicContact CD1-CD2 4Å; F379-L387 HydrophobicContact CD2-CD1 4.48Å; F379-L387 HydrophobicContact CD2-CD2 4.34Å; F379-L387 HydrophobicContact CE1-CD2 3.8Å; F379-L387 HydrophobicContact CE2-CD2 4.18Å; F379-L387 HydrophobicContact CG-CD1 4.12Å; F379-L387 HydrophobicContact CG-CD2 4.26Å; F379-L387 HydrophobicContact CZ-CD2 3.92Å; E383-L387 HydrophobicContact CB-CD1 4.12Å; E383-L387 HydrophobicContact CB-CG 4.21Å; E383-L387 WeakPolarHBondContact O-CB 3.25Å; E383-L387 VanDerWaalsContact O-CG 3.3Å; E383-L387 WeakPolarHBondContact O-CG 3.44Å; E383-L387 PolarHBondContact O-N 3.15Å; L387-N389 VanDerWaalsContact C-N 3.28Å; L387-N389 PolarHBondContact O-N 3.02Å; L387-A395 HydrophobicContact CD2-CB 4.08Å; L387-F398 HydrophobicContact CD1-CE1 4.2Å; L387-F398 HydrophobicContact CD1-CZ 4.3Å; L387-L406 HydrophobicContact CD1-CD1 4.08Å; L387-L406 HydrophobicContact CD1-CD2 4.16Å
388	L	97.4	Very high	97.5	Very high	7 Å²	7	19.5 Å²	19.5	4%	0.037	10%	0.103	C	C	.	.	H	α-helix	trans	-73.3	-18.9	-176.7	-70.4	178	0	0	0	114.1	Y63 L384 W386 L410 K413	Y63-L388 HydrophobicContact CD2-CD1 3.9Å; Y63-L388 HydrophobicContact CE2-CB 4.17Å; Y63-L388 HydrophobicContact CE2-CD1 3.94Å; L384-L388 HydrophobicContact CD1-CD1 3.83Å; L384-L388 HydrophobicContact CD1-CG 4.27Å; L384-L388 HydrophobicContact CG-CD1 4.24Å; L384-L388 WeakPolarHBondContact O-CG 2.92Å; L384-L388 PolarHBondContact O-N 2.69Å; L384-L388 VanDerWaalsContact O-N 3.16Å; W386-L388 VanDerWaalsContact C-N 3.35Å; W386-L388 PolarHBondContact O-N 3.38Å; L388-L410 HydrophobicContact CD1-CD2 4.49Å; L388-L410 HydrophobicContact CD2-CD2 3.73Å; L388-L410 HydrophobicContact CG-CD2 4.08Å; L388-K413 HydrophobicContact CD1-CB 3.76Å; L388-K413 HydrophobicContact CD1-CG 3.89Å
389	N	96.6	Very high	97.4	Very high	89 Å²	89	20.3 Å²	20.3	48%	0.476	11%	0.107	S	C	.	.	H	α-helix	trans	-107.8	-10	-176.9	-69.1	-67.6	0	0	0	114.1	Y63 H385 W386 L387 G391	Y63-N389 PolarHBondContact OH-ND2 2.95Å; H385-N389 WeakPolarHBondContact O-CB 3.17Å; H385-N389 PolarHBondContact O-N 3.45Å; H385-N389 PolarHBondContact O-ND2 3.3Å; W386-N389 PolarHBondContact O-N 3.36Å; W386-N389 VanDerWaalsContact O-N 3.15Å; L387-N389 VanDerWaalsContact C-N 3.28Å; L387-N389 PolarHBondContact O-N 3.02Å; N389-G391 PolarHBondContact O-N 2.97Å
390	Y	96	Very high	97	Very high	78 Å²	78	21.4 Å²	21.4	31%	0.306	12%	0.115	S	C	.	.	H	α-helix	trans	-71.3	-30.6	-175.3	-161.4	-104.3	0	0	0	113.8	L348 L354 W386 H392	L348-Y390 HydrophobicContact CD2-CE1 4.08Å; L354-Y390 HydrophobicContact CD1-CD1 3.53Å; L354-Y390 HydrophobicContact CD1-CE1 3.56Å; L354-Y390 HydrophobicContact CD1-CG 4.48Å; L354-Y390 HydrophobicContact CD2-CD1 3.74Å; L354-Y390 HydrophobicContact CD2-CG 4.07Å; L354-Y390 HydrophobicContact CG-CD1 4.28Å; W386-Y390 HydrophobicContact CD2-CD2 4.41Å; W386-Y390 AromaticContact CE2-CD2 3.42Å; W386-Y390 VanDerWaalsContact CE2-CD2 3.42Å; W386-Y390 AromaticContact CE2-CE2 3.82Å; W386-Y390 AromaticContact CE2-CG 3.97Å; W386-Y390 HydrophobicContact CZ2-CD1 4.24Å; W386-Y390 AromaticContact CZ2-CD2 3.49Å; W386-Y390 HydrophobicContact CZ2-CD2 3.49Å; W386-Y390 VanDerWaalsContact CZ2-CD2 3.49Å; W386-Y390 HydrophobicContact CZ2-CE1 4.32Å; W386-Y390 AromaticContact CZ2-CE2 3.55Å; W386-Y390 HydrophobicContact CZ2-CE2 3.55Å; W386-Y390 AromaticContact CZ2-CG 3.85Å; W386-Y390 HydrophobicContact CZ2-CG 3.85Å; W386-Y390 AromaticContact CZ2-CZ 3.99Å; W386-Y390 AromaticContact NE1-CD2 3.23Å; W386-Y390 AromaticContact NE1-CE2 3.63Å; W386-Y390 WeakPolarHBondContact O-CB 3.4Å; W386-Y390 PolarHBondContact O-N 3.24Å; Y390-H392 AromaticContact CD1-CE1 3.59Å; Y390-H392 AromaticContact CD1-ND1 3.31Å; Y390-H392 VanDerWaalsContact CD1-ND1 3.31Å; Y390-H392 WeakPolarHBondContact CD1-ND1 3.27Å; Y390-H392 AromaticContact CE1-CE1 3.53Å; Y390-H392 AromaticContact CE1-ND1 3.78Å
391	G	96	Very high	96.7	Very high	24 Å²	24	26.5 Å²	26.5	25%	0.247	14%	0.137	C	C	.	.			trans	114.8	-7.4	169.4	0	0	0	0	0	116.4	N389	N389-G391 PolarHBondContact O-N 2.97Å
392	H	98.3	Very high	96.5	Very high	6 Å²	6	27 Å²	27	3%	0.028	14%	0.14	C	C	.	.			trans	-72.3	159.9	172.9	-66.7	62.5	0	0	0	112.2	L219 D347 L348 S350 K351 R353 L354 Y390	L219-H392 HydrophobicContact CD1-CB 4.2Å; D347-H392 PolarHBondContact O-NE2 2.93Å; D347-H392 VanDerWaalsContact O-NE2 3.1Å; L348-H392 PolarHBondContact O-CE1 3.39Å; S350-H392 PolarHBondContact O-CD2 3.25Å; S350-H392 PolarHBondContact O-NE2 3.3Å; K351-H392 WeakPolarHBondContact O-CA 3.46Å; R353-H392 VanDerWaalsContact C-CD2 3.41Å; L354-H392 HydrophobicContact CB-CB 3.77Å; L354-H392 PolarHBondContact N-CD2 3.37Å; Y390-H392 AromaticContact CD1-CE1 3.59Å; Y390-H392 AromaticContact CD1-ND1 3.31Å; Y390-H392 VanDerWaalsContact CD1-ND1 3.31Å; Y390-H392 WeakPolarHBondContact CD1-ND1 3.27Å; Y390-H392 AromaticContact CE1-CE1 3.53Å; Y390-H392 AromaticContact CE1-ND1 3.78Å
393	W	98.6	Very high	96.4	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.008	12%	0.124	C	C	.	.	S	Bend	trans	-86.2	-33.6	179.4	-59	-30.4	0	0	0	112.7	L219 L225 E228 L229 L232 M237 V292 K351 T352	L219-W393 PolarHBondContact N-O 2.9Å; L225-W393 HydrophobicContact CD1-CB 3.87Å; L225-W393 HydrophobicContact CD1-CD2 3.92Å; L225-W393 HydrophobicContact CD1-CE3 4.39Å; L225-W393 HydrophobicContact CD1-CG 3.68Å; E228-W393 HydrophobicContact CB-CZ2 4.17Å; L229-W393 HydrophobicContact CD2-CE3 4.3Å; L229-W393 HydrophobicContact CD2-CH2 3.77Å; L229-W393 HydrophobicContact CD2-CZ2 4.18Å; L229-W393 HydrophobicContact CD2-CZ3 3.83Å; L232-W393 HydrophobicContact CD1-CH2 3.88Å; L232-W393 HydrophobicContact CD2-CH2 4.23Å; L232-W393 HydrophobicContact CG-CH2 4.41Å; M237-W393 HydrophobicContact CB-CH2 3.87Å; M237-W393 HydrophobicContact CB-CZ3 3.91Å; M237-W393 HydrophobicContact CG-CH2 3.69Å; M237-W393 HydrophobicContact CG-CZ3 3.72Å; V292-W393 HydrophobicContact CB-CZ3 3.91Å; V292-W393 HydrophobicContact CG1-CZ3 4.26Å; V292-W393 HydrophobicContact CG2-CE3 3.78Å; V292-W393 HydrophobicContact CG2-CZ3 3.59Å; K351-W393 HydrophobicContact CB-CD2 3.78Å; K351-W393 HydrophobicContact CB-CE3 4.16Å; K351-W393 HydrophobicContact CB-CG 4.24Å; K351-W393 HydrophobicContact CB-CH2 4.19Å; K351-W393 HydrophobicContact CB-CZ2 3.85Å; K351-W393 HydrophobicContact CB-CZ3 4.33Å; K351-W393 HydrophobicContact CD-CZ2 3.87Å; K351-W393 HydrophobicContact CG-CZ2 4.46Å; K351-W393 PolarHBondContact O-N 2.86Å; T352-W393 HydrophobicContact CG2-CZ3 4.44Å
394	F	98.8	Very high	96.2	Very high	1 Å²	1	25.1 Å²	25.1	0%	0.004	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	163.3	178	-61.5	-96.3	0	0	0	110.8	Y121 V139 I210 L212 F217 P218 L225 R353 L354	Y121-F394 AromaticContact CE1-CZ 3.97Å; Y121-F394 HydrophobicContact CE1-CZ 3.97Å; V139-F394 HydrophobicContact CG1-CE1 3.8Å; V139-F394 HydrophobicContact CG1-CZ 4.36Å; I210-F394 HydrophobicContact CD1-CE2 3.9Å; I210-F394 HydrophobicContact CD1-CZ 4.25Å; I210-F394 HydrophobicContact CG2-CD2 4.36Å; I210-F394 HydrophobicContact CG2-CE2 3.85Å; I210-F394 HydrophobicContact CG2-CZ 4.28Å; L212-F394 HydrophobicContact CD1-CE1 4.15Å; L212-F394 HydrophobicContact CD2-CD1 3.56Å; L212-F394 HydrophobicContact CD2-CD2 4.41Å; L212-F394 HydrophobicContact CD2-CE1 3.67Å; L212-F394 HydrophobicContact CD2-CG 3.99Å; L212-F394 HydrophobicContact CD2-CZ 4.18Å; F217-F394 WeakPolarHBondContact O-CA 3.47Å; P218-F394 VanDerWaalsContact CA-CD1 3.48Å; P218-F394 HydrophobicContact CB-CD1 3.95Å; P218-F394 HydrophobicContact CB-CE1 3.74Å; L225-F394 HydrophobicContact CD1-CE2 4.49Å; L225-F394 HydrophobicContact CD2-CE2 4.01Å; L225-F394 HydrophobicContact CD2-CZ 3.92Å; R353-F394 CarbonylContact C-O 3.49Å; R353-F394 WeakPolarHBondContact CA-O 3.45Å; L354-F394 PolarHBondContact N-O 3.45Å
395	A	98.8	Very high	96	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	155.5	176	0	0	0	0	0	112.1	D216 F217 L219 L354 F379 L387 F398	D216-A395 WeakPolarHBondContact CA-O 3.38Å; F217-A395 PolarHBondContact N-O 2.96Å; F217-A395 PolarHBondContact O-N 2.99Å; L219-A395 HydrophobicContact CD1-CB 3.82Å; L219-A395 HydrophobicContact CD2-CB 4.06Å; L219-A395 HydrophobicContact CG-CB 4.05Å; L354-A395 HydrophobicContact CB-CB 4.23Å; L354-A395 CarbonylContact O-C 3.55Å; L354-A395 VanDerWaalsContact O-CA 3.31Å; L354-A395 WeakPolarHBondContact O-CA 3.35Å; F379-A395 HydrophobicContact CD2-CB 4.4Å; F379-A395 HydrophobicContact CE2-CB 3.69Å; F379-A395 HydrophobicContact CZ-CB 4.24Å; L387-A395 HydrophobicContact CD2-CB 4.08Å; A395-F398 HydrophobicContact CB-CE2 3.54Å; A395-F398 HydrophobicContact CB-CZ 3.64Å; A395-F398 WeakPolarHBondContact O-CE2 3.47Å
396	N	98.6	Very high	96	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.027	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	127.1	173.3	-166.6	-112	0	0	0	109.1	C213 D216 R353 L354 V355 F379	C213-N396 PolarHBondContact SG-ND2 2.92Å; C213-N396 VanDerWaalsContact SG-ND2 3.44Å; D216-N396 VanDerWaalsContact OD1-CB 3.27Å; D216-N396 WeakPolarHBondContact OD1-CB 3.29Å; D216-N396 PolarHBondContact OD1-ND2 3.02Å; R353-N396 HydrophobicContact CG-CB 3.87Å; L354-N396 PolarHBondContact O-N 3.32Å; V355-N396 HydrophobicContact CG2-CB 4.05Å; F379-N396 WeakPolarHBondContact CE2-O 3.04Å; F379-N396 WeakPolarHBondContact CZ-O 3.44Å
397	K	98.3	Very high	95.9	Very high	26 Å²	26	20 Å²	20	11%	0.113	10%	0.103	C	C	.	.			cis	-120.9	155	13.1	-67.6	174.8	-172.6	170.1	0	113.1	Q215 V376 C377 I378 F379	Q215-K397 HydrophobicContact CB-CB 4.35Å; Q215-K397 HydrophobicContact CB-CG 4.4Å; V376-K397 HydrophobicContact CB-CD 4.5Å; V376-K397 HydrophobicContact CG1-CD 4Å; V376-K397 HydrophobicContact CG1-CG 4.1Å; C377-K397 PolarHBondContact O-N 2.86Å; I378-K397 WeakPolarHBondContact CA-O 3.3Å; I378-K397 HydrophobicContact CG1-CB 4.07Å; F379-K397 WeakPolarHBondContact CD2-O 3.44Å; F379-K397 PolarHBondContact N-O 3.38Å
398	F	97.7	Very high	95.7	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.009	11%	0.105	C	C	.	.			trans	-119.2	142	167.9	-58.4	-90.9	0	0	0	110.8	M131 Q215 F217 F379 L387 A395 L406 L407 L410	M131-F398 HydrophobicContact CE-CB 3.86Å; Q215-F398 PolarHBondContact NE2-O 2.86Å; Q215-F398 PolarHBondContact O-N 2.85Å; F217-F398 HydrophobicContact CB-CD1 4.41Å; F217-F398 HydrophobicContact CB-CD2 3.33Å; F217-F398 HydrophobicContact CB-CE1 4.41Å; F217-F398 HydrophobicContact CB-CE2 3.31Å; F217-F398 HydrophobicContact CB-CG 3.91Å; F217-F398 HydrophobicContact CB-CZ 3.89Å; F379-F398 HydrophobicContact CB-CE1 4.23Å; F379-F398 HydrophobicContact CD2-CD1 4.38Å; F379-F398 AromaticContact CD2-CE1 3.92Å; F379-F398 HydrophobicContact CD2-CE1 3.92Å; F379-F398 HydrophobicContact CD2-CE2 4.1Å; F379-F398 AromaticContact CD2-CZ 3.78Å; F379-F398 HydrophobicContact CD2-CZ 3.78Å; F379-F398 HydrophobicContact CE2-CE2 4.38Å; F379-F398 HydrophobicContact CE2-CZ 4.3Å; F379-F398 HydrophobicContact CG-CE1 4.48Å; L387-F398 HydrophobicContact CD1-CE1 4.2Å; L387-F398 HydrophobicContact CD1-CZ 4.3Å; A395-F398 HydrophobicContact CB-CE2 3.54Å; A395-F398 HydrophobicContact CB-CZ 3.64Å; A395-F398 WeakPolarHBondContact O-CE2 3.47Å; F398-L406 HydrophobicContact CD1-CD2 3.74Å; F398-L406 HydrophobicContact CD1-CG 4.23Å; F398-L406 HydrophobicContact CE1-CD2 3.54Å; F398-L406 HydrophobicContact CE1-CG 4.01Å; F398-L407 HydrophobicContact CB-CD2 3.79Å; F398-L407 HydrophobicContact CB-CG 4.34Å; F398-L407 HydrophobicContact CD1-CD2 4.02Å; F398-L407 HydrophobicContact CG-CD2 4.04Å; F398-L410 HydrophobicContact CD1-CD1 4.08Å; F398-L410 HydrophobicContact CE1-CD1 3.28Å; F398-L410 HydrophobicContact CZ-CD1 3.67Å
399	D	94.7	Very high	95.7	Very high	22 Å²	22	20.2 Å²	20.2	12%	0.118	10%	0.104	C	C	.	.			trans	-147.3	120.5	174.1	-167.9	-32.5	0	0	0	108.7	I378 K401 V402 D403	I378-D399 HydrophobicContact CD1-CB 4.33Å; I378-D399 HydrophobicContact CG2-CB 3.7Å; D399-K401 PolarHBondContact O-N 3.43Å; D399-K401 VanDerWaalsContact O-N 3.12Å; D399-K401 VanDerWaalsContact OD1-CB 3.31Å; D399-K401 WeakPolarHBondContact OD1-CB 3.5Å; D399-K401 PolarHBondContact OD1-N 2.68Å; D399-V402 HydrophobicContact CB-CB 4.3Å; D399-V402 HydrophobicContact CB-CG2 3.92Å; D399-V402 WeakPolarHBondContact O-CB 3.33Å; D399-V402 PolarHBondContact O-N 2.83Å; D399-D403 PolarHBondContact O-N 2.98Å; D399-D403 VanDerWaalsContact O-N 3.13Å
400	P	90.8	Very high	95.8	Very high	26 Å²	26	16 Å²	16	17%	0.169	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.6	178.6	25.2	-34.4	0	0	0	112.9	V81 V402 P404 L407	V81-P400 WeakPolarHBondContact CG1-O 3.48Å; P400-V402 VanDerWaalsContact C-N 3.28Å; P400-V402 PolarHBondContact O-N 3.12Å; P400-P404 VanDerWaalsContact O-CD 3.3Å; P400-P404 WeakPolarHBondContact O-CD 3.31Å; P400-L407 HydrophobicContact CB-CD1 4.08Å
401	K	89.8	Confident	95.8	Very high	106 Å²	106	13 Å²	13	46%	0.461	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.7	173.8	-67.3	177	174	161.9	0	113.3	E83 D399	E83-K401 WeakPolarHBondContact OE1-CE 3.33Å; E83-K401 IonicContact OE1-NZ 2.63Å; E83-K401 PolarHBondContact OE1-NZ 3.4Å; E83-K401 WeakPolarHBondContact OE2-CE 3.27Å; E83-K401 IonicContact OE2-NZ 3.77Å; E83-K401 PolarHBondContact OE2-NZ 2.93Å; D399-K401 PolarHBondContact O-N 3.43Å; D399-K401 VanDerWaalsContact O-N 3.12Å; D399-K401 VanDerWaalsContact OD1-CB 3.31Å; D399-K401 WeakPolarHBondContact OD1-CB 3.5Å; D399-K401 PolarHBondContact OD1-N 2.68Å
402	V	92.9	Very high	95.8	Very high	12 Å²	12	13.9 Å²	13.9	7%	0.073	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-51.3	179.5	176.5	0	0	0	0	109.9	Q371 I378 D399 P400	Q371-V402 HydrophobicContact CB-CG1 4.49Å; Q371-V402 VanDerWaalsContact CD-CG2 3.41Å; Q371-V402 HydrophobicContact CG-CB 4.44Å; Q371-V402 HydrophobicContact CG-CG1 3.86Å; Q371-V402 HydrophobicContact CG-CG2 3.66Å; I378-V402 HydrophobicContact CB-CB 4.44Å; I378-V402 HydrophobicContact CB-CG1 4.21Å; I378-V402 HydrophobicContact CB-CG2 4.15Å; I378-V402 HydrophobicContact CD1-CG2 3.98Å; I378-V402 HydrophobicContact CG2-CB 3.73Å; I378-V402 HydrophobicContact CG2-CG1 3.89Å; I378-V402 HydrophobicContact CG2-CG2 3.7Å; D399-V402 HydrophobicContact CB-CB 4.3Å; D399-V402 HydrophobicContact CB-CG2 3.92Å; D399-V402 WeakPolarHBondContact O-CB 3.33Å; D399-V402 PolarHBondContact O-N 2.83Å; P400-V402 VanDerWaalsContact C-N 3.28Å; P400-V402 PolarHBondContact O-N 3.12Å
403	D	93.4	Very high	95.7	Very high	3 Å²	3	14.4 Å²	14.4	2%	0.016	7%	0.07	C	C	.	.			trans	-154.4	95.4	-179.6	-156.1	-46.5	0	0	0	111.3	R77 G380 A381 D399 I405 L406	R77-D403 IonicContact NH1-OD2 3.9Å; G380-D403 WeakPolarHBondContact CA-OD2 3.37Å; A381-D403 PolarHBondContact N-OD2 2.05Å; D399-D403 PolarHBondContact O-N 2.98Å; D399-D403 VanDerWaalsContact O-N 3.13Å; D403-I405 PolarHBondContact O-N 3.03Å; D403-I405 VanDerWaalsContact OD1-CB 3.31Å; D403-I405 WeakPolarHBondContact OD1-CB 3Å; D403-I405 PolarHBondContact OD1-N 3.16Å; D403-I405 VanDerWaalsContact OD1-N 3.08Å; D403-L406 HydrophobicContact CB-CB 4.28Å; D403-L406 PolarHBondContact OD1-N 3.43Å
404	P	92.2	Very high	95.5	Very high	9 Å²	9	14.9 Å²	14.9	6%	0.058	7%	0.072	C	C	.	.	H	α-helix	trans	-72.3	-22	177.3	30.5	-34	0	0	0	111.9	V81 P400 Q408	V81-P404 HydrophobicContact CG1-CB 4.26Å; V81-P404 HydrophobicContact CG1-CG 4.02Å; V81-P404 HydrophobicContact CG2-CG 3.89Å; P400-P404 VanDerWaalsContact O-CD 3.3Å; P400-P404 WeakPolarHBondContact O-CD 3.31Å; P404-Q408 PolarHBondContact O-N 2.75Å; P404-Q408 VanDerWaalsContact O-N 3.12Å
405	I	94.9	Very high	95.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-69.3	-42.7	-179.2	-56.9	-54	0	0	0	110.2	H55 I57 I62 I76 A381 D403 L407 Q408 C409	H55-I405 HydrophobicContact CB-CD1 3.31Å; H55-I405 VanDerWaalsContact CD2-CD1 3.46Å; H55-I405 WeakPolarHBondContact CD2-CD1 3.37Å; I57-I405 HydrophobicContact CB-CG2 4.38Å; I57-I405 HydrophobicContact CG1-CD1 3.95Å; I57-I405 HydrophobicContact CG1-CG1 4.49Å; I57-I405 HydrophobicContact CG1-CG2 4.3Å; I57-I405 HydrophobicContact CG2-CG2 3.81Å; I62-I405 HydrophobicContact CG1-CG2 4.49Å; I76-I405 HydrophobicContact CB-CD1 4.45Å; I76-I405 HydrophobicContact CB-CG1 4.44Å; I76-I405 HydrophobicContact CD1-CD1 3.96Å; I76-I405 HydrophobicContact CD1-CG1 4.47Å; I76-I405 HydrophobicContact CG2-CD1 3.99Å; I76-I405 HydrophobicContact CG2-CG1 4.27Å; A381-I405 HydrophobicContact CB-CB 4.13Å; A381-I405 HydrophobicContact CB-CG2 4Å; D403-I405 PolarHBondContact O-N 3.03Å; D403-I405 VanDerWaalsContact OD1-CB 3.31Å; D403-I405 WeakPolarHBondContact OD1-CB 3Å; D403-I405 PolarHBondContact OD1-N 3.16Å; D403-I405 VanDerWaalsContact OD1-N 3.08Å; I405-L407 VanDerWaalsContact C-N 3.3Å; I405-L407 PolarHBondContact O-N 2.98Å; I405-Q408 PolarHBondContact O-N 3.31Å; I405-C409 WeakPolarHBondContact O-CB 3.02Å; I405-C409 PolarHBondContact O-N 3.16Å; I405-C409 PolarHBondContact O-SG 2.79Å
406	L	96.3	Very high	94.9	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-55.9	-46.9	177.2	179.1	58.6	0	0	0	111.8	F379 G380 A381 L384 L387 F398 D403 C409 L410	F379-L406 HydrophobicContact CB-CD2 3.33Å; F379-L406 WeakPolarHBondContact O-CD2 3.5Å; G380-L406 WeakPolarHBondContact O-CD2 3.38Å; A381-L406 HydrophobicContact CB-CB 4.4Å; L384-L406 HydrophobicContact CB-CD1 4Å; L384-L406 HydrophobicContact CD1-CD1 4.06Å; L387-L406 HydrophobicContact CD1-CD1 4.08Å; L387-L406 HydrophobicContact CD1-CD2 4.16Å; F398-L406 HydrophobicContact CD1-CD2 3.74Å; F398-L406 HydrophobicContact CD1-CG 4.23Å; F398-L406 HydrophobicContact CE1-CD2 3.54Å; F398-L406 HydrophobicContact CE1-CG 4.01Å; D403-L406 HydrophobicContact CB-CB 4.28Å; D403-L406 PolarHBondContact OD1-N 3.43Å; L406-C409 PolarHBondContact O-N 2.92Å; L406-L410 HydrophobicContact CD1-CD1 4.1Å; L406-L410 HydrophobicContact CD1-CG 4.2Å; L406-L410 HydrophobicContact CG-CD1 4.06Å; L406-L410 WeakPolarHBondContact O-CB 3.27Å; L406-L410 WeakPolarHBondContact O-CG 3.34Å; L406-L410 PolarHBondContact O-N 2.93Å
407	L	95.2	Very high	94.5	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-65.4	-43.5	179.6	-73.3	167.6	0	0	0	112	M131 R134 F217 F398 P400 I405 C409 L410 E411	M131-L407 HydrophobicContact CE-CD1 4.44Å; M131-L407 HydrophobicContact CE-CD2 3.88Å; M131-L407 HydrophobicContact SD-CD1 3.76Å; M131-L407 HydrophobicContact SD-CD2 4.19Å; R134-L407 VanDerWaalsContact NH1-CB 3.31Å; R134-L407 VanDerWaalsContact NH2-C 3.26Å; F217-L407 HydrophobicContact CD1-CD2 4.41Å; F217-L407 HydrophobicContact CD2-CD2 3.61Å; F217-L407 HydrophobicContact CE2-CD2 3.83Å; F217-L407 HydrophobicContact CG-CD2 3.92Å; F217-L407 HydrophobicContact CZ-CD2 4.33Å; F398-L407 HydrophobicContact CB-CD2 3.79Å; F398-L407 HydrophobicContact CB-CG 4.34Å; F398-L407 HydrophobicContact CD1-CD2 4.02Å; F398-L407 HydrophobicContact CG-CD2 4.04Å; P400-L407 HydrophobicContact CB-CD1 4.08Å; I405-L407 VanDerWaalsContact C-N 3.3Å; I405-L407 PolarHBondContact O-N 2.98Å; L407-C409 VanDerWaalsContact C-N 3.28Å; L407-C409 PolarHBondContact O-N 3.16Å; L407-L410 PolarHBondContact O-N 3.43Å; L407-E411 VanDerWaalsContact O-CG 3.31Å; L407-E411 WeakPolarHBondContact O-CG 3.44Å; L407-E411 PolarHBondContact O-N 3.41Å
408	Q	94.9	Very high	94	Very high	12 Å²	12	25 Å²	25	6%	0.056	12%	0.119	C	C	.	.	H	α-helix	trans	-57.3	-45.9	174.9	178.1	-178.3	-37.2	0	0	110.5	H55 R134 P404 I405 E411 E412	H55-Q408 PolarHBondContact O-NE2 3.4Å; H55-Q408 VanDerWaalsContact O-NE2 3.12Å; R134-Q408 VanDerWaalsContact NH2-N 3.19Å; P404-Q408 PolarHBondContact O-N 2.75Å; P404-Q408 VanDerWaalsContact O-N 3.12Å; I405-Q408 PolarHBondContact O-N 3.31Å; Q408-E411 PolarHBondContact O-N 2.98Å; Q408-E412 PolarHBondContact NE2-OE1 2.89Å; Q408-E412 WeakPolarHBondContact O-CG 3.49Å; Q408-E412 PolarHBondContact O-N 3.38Å
409	C	97.4	Very high	93.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-73.2	-32.5	-177.2	-63.4	0	0	0	0	113.7	C59 L384 I405 L406 L407 K413	C59-C409 WeakPolarHBondContact CA-SG 3.39Å; C59-C409 HydrophobicContact CB-CB 3.48Å; C59-C409 VanDerWaalsContact CB-CB 3.48Å; C59-C409 WeakPolarHBondContact CB-SG 3.47Å; C59-C409 WeakPolarHBondContact SG-CA 3.21Å; C59-C409 WeakPolarHBondContact SG-CB 3.49Å; C59-C409 CovalentContact SG-SG 2.05Å; C59-C409 PolarHBondContact SG-SG 3.26Å; L384-C409 HydrophobicContact CD1-CB 4.35Å; L384-C409 HydrophobicContact CD2-CB 3.55Å; I405-C409 WeakPolarHBondContact O-CB 3.02Å; I405-C409 PolarHBondContact O-N 3.16Å; I405-C409 PolarHBondContact O-SG 2.79Å; L406-C409 PolarHBondContact O-N 2.92Å; L407-C409 VanDerWaalsContact C-N 3.28Å; L407-C409 PolarHBondContact O-N 3.16Å; C409-K413 WeakPolarHBondContact O-CB 3.37Å; C409-K413 VanDerWaalsContact O-CG 3.27Å; C409-K413 WeakPolarHBondContact O-CG 3.34Å; C409-K413 PolarHBondContact O-N 3.27Å
410	L	97.8	Very high	92.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-46	170.2	-79.4	170	0	0	0	111.3	F217 L219 L384 L388 F398 L406 L407 K413 L414	F217-L410 HydrophobicContact CD1-CB 3.89Å; F217-L410 HydrophobicContact CD1-CD1 3.93Å; F217-L410 HydrophobicContact CD1-CG 4.5Å; F217-L410 HydrophobicContact CE1-CB 3.8Å; L219-L410 HydrophobicContact CD2-CD2 4.1Å; L384-L410 HydrophobicContact CD1-CD2 3.61Å; L384-L410 HydrophobicContact CD1-CG 3.77Å; L388-L410 HydrophobicContact CD1-CD2 4.49Å; L388-L410 HydrophobicContact CD2-CD2 3.73Å; L388-L410 HydrophobicContact CG-CD2 4.08Å; F398-L410 HydrophobicContact CD1-CD1 4.08Å; F398-L410 HydrophobicContact CE1-CD1 3.28Å; F398-L410 HydrophobicContact CZ-CD1 3.67Å; L406-L410 HydrophobicContact CD1-CD1 4.1Å; L406-L410 HydrophobicContact CD1-CG 4.2Å; L406-L410 HydrophobicContact CG-CD1 4.06Å; L406-L410 WeakPolarHBondContact O-CB 3.27Å; L406-L410 WeakPolarHBondContact O-CG 3.34Å; L406-L410 PolarHBondContact O-N 2.93Å; L407-L410 PolarHBondContact O-N 3.43Å; L410-K413 PolarHBondContact O-N 3.05Å; L410-L414 WeakPolarHBondContact O-CB 3.2Å; L410-L414 WeakPolarHBondContact O-CG 3.48Å; L410-L414 PolarHBondContact O-N 2.93Å
411	E	96.2	Very high	92	Very high	16 Å²	16	38.6 Å²	38.6	8%	0.075	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-50.7	175.7	-69.6	169.1	145.6	0	0	111.4	R134 R137 F217 L407 Q408 K413 L414 E415	R134-E411 IonicContact CZ-OE1 3.93Å; R134-E411 IonicContact CZ-OE2 2.62Å; R134-E411 IonicContact NE-OE1 2.64Å; R134-E411 PolarHBondContact NE-OE1 3.04Å; R134-E411 IonicContact NE-OE2 3.96Å; R134-E411 VanDerWaalsContact NH2-CD 3.31Å; R134-E411 IonicContact NH2-OE1 3.67Å; R134-E411 IonicContact NH2-OE2 2.68Å; R134-E411 PolarHBondContact NH2-OE2 3.31Å; R137-E411 IonicContact CZ-OE1 3.01Å; R137-E411 IonicContact NH2-OE1 3.81Å; R137-E411 PolarHBondContact NH2-OE1 2.93Å; R137-E411 IonicContact NH2-OE2 3.91Å; R137-E411 PolarHBondContact NH2-OE2 3.18Å; F217-E411 HydrophobicContact CE1-CG 4.03Å; F217-E411 HydrophobicContact CZ-CG 3.57Å; L407-E411 VanDerWaalsContact O-CG 3.31Å; L407-E411 WeakPolarHBondContact O-CG 3.44Å; L407-E411 PolarHBondContact O-N 3.41Å; Q408-E411 PolarHBondContact O-N 2.98Å; E411-K413 VanDerWaalsContact C-N 3.34Å; E411-K413 PolarHBondContact O-N 2.95Å; E411-L414 PolarHBondContact O-N 2.04Å; E411-E415 WeakPolarHBondContact O-CB 3.41Å; E411-E415 WeakPolarHBondContact O-CG 3.33Å; E411-E415 PolarHBondContact O-N 3.42Å
412	E	96.1	Very high	91.2	Very high	42 Å²	42	35.6 Å²	35.6	20%	0.196	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-43.1	178.4	-71.9	-174.4	-172.8	0	0	111.8	K54 C59 Q408 E415 E416	K54-E412 WeakPolarHBondContact CE-OE1 3.01Å; K54-E412 IonicContact NZ-OE1 3.44Å; K54-E412 PolarHBondContact NZ-OE1 2.59Å; C59-E412 HydrophobicContact CB-CB 4.45Å; C59-E412 WeakPolarHBondContact CB-OE2 3.33Å; C59-E412 PolarHBondContact SG-OE2 3.41Å; Q408-E412 PolarHBondContact NE2-OE1 2.89Å; Q408-E412 WeakPolarHBondContact O-CG 3.49Å; Q408-E412 PolarHBondContact O-N 3.38Å; E412-E415 PolarHBondContact O-N 2.98Å; E412-E416 WeakPolarHBondContact O-CB 3.43Å; E412-E416 VanDerWaalsContact O-CG 3.3Å; E412-E416 WeakPolarHBondContact O-CG 3.45Å; E412-E416 PolarHBondContact O-N 3.48Å
413	K	96.5	Very high	90.2	Very high	17 Å²	17	43.6 Å²	43.6	7%	0.074	20%	0.201	C	C	.	.	H	α-helix	trans	-68.6	-37.2	178.9	-71.4	-45.5	-175.3	-164.1	0	113.6	L388 C409 L410 E411 E416 K417	L388-K413 HydrophobicContact CD1-CB 3.76Å; L388-K413 HydrophobicContact CD1-CG 3.89Å; C409-K413 WeakPolarHBondContact O-CB 3.37Å; C409-K413 VanDerWaalsContact O-CG 3.27Å; C409-K413 WeakPolarHBondContact O-CG 3.34Å; C409-K413 PolarHBondContact O-N 3.27Å; L410-K413 PolarHBondContact O-N 3.05Å; E411-K413 VanDerWaalsContact C-N 3.34Å; E411-K413 PolarHBondContact O-N 2.95Å; K413-E416 VanDerWaalsContact CD-OE2 3.28Å; K413-E416 WeakPolarHBondContact CD-OE2 3.32Å; K413-E416 VanDerWaalsContact NZ-CD 3.28Å; K413-E416 IonicContact NZ-OE1 3.49Å; K413-E416 PolarHBondContact NZ-OE1 3.2Å; K413-E416 IonicContact NZ-OE2 3.04Å; K413-E416 PolarHBondContact NZ-OE2 2.71Å; K413-K417 WeakPolarHBondContact O-CB 3.5Å; K413-K417 VanDerWaalsContact O-CG 3.31Å; K413-K417 WeakPolarHBondContact O-CG 3.06Å; K413-K417 PolarHBondContact O-N 3.5Å
414	L	95.1	Very high	89	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-40.6	175.7	-68.4	170.6	0	0	0	111.4	F217 P218 K220 L410 E411 K417 Q418	F217-L414 HydrophobicContact CE1-CD1 4.14Å; P218-L414 HydrophobicContact CB-CD1 4.21Å; P218-L414 HydrophobicContact CG-CD1 3.73Å; K220-L414 VanDerWaalsContact C-CD2 3.41Å; L410-L414 WeakPolarHBondContact O-CB 3.2Å; L410-L414 WeakPolarHBondContact O-CG 3.48Å; L410-L414 PolarHBondContact O-N 2.93Å; E411-L414 PolarHBondContact O-N 2.04Å; L414-K417 PolarHBondContact O-N 3.34Å; L414-Q418 PolarHBondContact O-N 3.49Å
415	E	92.3	Very high	87.9	Confident	79 Å²	79	49.3 Å²	49.3	37%	0.369	25%	0.25	S	C	.	.	H	α-helix	trans	-64.4	-42.7	174.4	-72.6	178.6	-163.9	0	0	111.9	R137 E411 E412 Q418 K419	R137-E415 IonicContact CZ-OE1 2.97Å; R137-E415 IonicContact NH1-OE1 3.38Å; R137-E415 PolarHBondContact NH1-OE1 3.38Å; E411-E415 WeakPolarHBondContact O-CB 3.41Å; E411-E415 WeakPolarHBondContact O-CG 3.33Å; E411-E415 PolarHBondContact O-N 3.42Å; E412-E415 PolarHBondContact O-N 2.98Å; E415-Q418 PolarHBondContact O-N 3.04Å; E415-K419 WeakPolarHBondContact O-CB 3.43Å; E415-K419 WeakPolarHBondContact O-CG 3.43Å; E415-K419 PolarHBondContact O-N 3.49Å
416	E	92.6	Very high	86.8	Confident	82 Å²	82	57.2 Å²	57.2	38%	0.383	29%	0.289	S	S	.	.	H	α-helix	trans	-57.2	-48.5	173.4	-79	174.7	-159.6	0	0	111.1	E412 K413 Q418 K419 L420	E412-E416 WeakPolarHBondContact O-CB 3.43Å; E412-E416 VanDerWaalsContact O-CG 3.3Å; E412-E416 WeakPolarHBondContact O-CG 3.45Å; E412-E416 PolarHBondContact O-N 3.48Å; K413-E416 VanDerWaalsContact CD-OE2 3.28Å; K413-E416 WeakPolarHBondContact CD-OE2 3.32Å; K413-E416 VanDerWaalsContact NZ-CD 3.28Å; K413-E416 IonicContact NZ-OE1 3.49Å; K413-E416 PolarHBondContact NZ-OE1 3.2Å; K413-E416 IonicContact NZ-OE2 3.04Å; K413-E416 PolarHBondContact NZ-OE2 2.71Å; E416-Q418 PolarHBondContact O-N 3.25Å; E416-K419 PolarHBondContact O-N 2.88Å; E416-L420 WeakPolarHBondContact O-CG 3.45Å; E416-L420 PolarHBondContact O-N 3.46Å
417	K	90.5	Very high	86	Confident	51 Å²	51	59.8 Å²	59.8	22%	0.222	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-44.1	178.3	-76.4	-177.5	171.9	-161.8	0	112.3	E224 K413 L414 K419 L420 F421	E224-K417 IonicContact OE1-NZ 2.68Å; E224-K417 PolarHBondContact OE1-NZ 2.77Å; E224-K417 WeakPolarHBondContact OE2-CD 3.28Å; E224-K417 IonicContact OE2-NZ 2.98Å; E224-K417 PolarHBondContact OE2-NZ 3.27Å; K413-K417 WeakPolarHBondContact O-CB 3.5Å; K413-K417 VanDerWaalsContact O-CG 3.31Å; K413-K417 WeakPolarHBondContact O-CG 3.06Å; K413-K417 PolarHBondContact O-N 3.5Å; L414-K417 PolarHBondContact O-N 3.34Å; K417-K419 PolarHBondContact O-N 3.33Å; K417-L420 PolarHBondContact O-N 3.48Å; K417-F421 PolarHBondContact O-N 3.31Å
418	Q	86.2	Confident	85	Confident	31 Å²	31	63 Å²	63	15%	0.145	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-46.6	176	-170.7	70.2	10.8	0	0	110.6	E114 S221 L414 E415 E416 L420 F421 Q422	E114-Q418 PolarHBondContact OE1-NE2 2.98Å; E114-Q418 VanDerWaalsContact OE1-NE2 3.15Å; S221-Q418 PolarHBondContact OG-OE1 2.95Å; L414-Q418 PolarHBondContact O-N 3.49Å; E415-Q418 PolarHBondContact O-N 3.04Å; E416-Q418 PolarHBondContact O-N 3.25Å; Q418-L420 PolarHBondContact O-N 2.99Å; Q418-F421 PolarHBondContact O-N 3.17Å; Q418-Q422 WeakPolarHBondContact O-CB 3.35Å; Q418-Q422 WeakPolarHBondContact O-CG 3.5Å; Q418-Q422 PolarHBondContact O-N 2.72Å
419	K	85.2	Confident	84.2	Confident	116 Å²	116	65.1 Å²	65.1	50%	0.504	34%	0.338	S	S	.	.	H	α-helix	trans	-65.3	-37.4	179.5	-74	170.5	-177.3	164.9	0	113.3	E415 E416 K417 F421 Q422 K423	E415-K419 WeakPolarHBondContact O-CB 3.43Å; E415-K419 WeakPolarHBondContact O-CG 3.43Å; E415-K419 PolarHBondContact O-N 3.49Å; E416-K419 PolarHBondContact O-N 2.88Å; K417-K419 PolarHBondContact O-N 3.33Å; K419-F421 VanDerWaalsContact C-N 3.34Å; K419-Q422 WeakPolarHBondContact O-CB 3.37Å; K419-Q422 PolarHBondContact O-N 2.82Å; K419-K423 PolarHBondContact O-N 3.07Å
420	L	84.6	Confident	82.8	Confident	116 Å²	116	68.7 Å²	68.7	61%	0.607	36%	0.361	S	S	*	.	H	α-helix	trans	-63	-42.4	176.7	-76.1	170.5	0	0	0	111.4	E416 K417 Q418 K423	E416-L420 WeakPolarHBondContact O-CG 3.45Å; E416-L420 PolarHBondContact O-N 3.46Å; K417-L420 PolarHBondContact O-N 3.48Å; Q418-L420 PolarHBondContact O-N 2.99Å; L420-K423 PolarHBondContact O-N 3.25Å
421	F	72.6	Confident	80.7	Confident	104 Å²	104	78.6 Å²	78.6	46%	0.456	40%	0.404	S	S	.	.	H	α-helix	trans	-65.1	-44.2	174	-99.7	-87.4	0	0	0	112.5	M223 K417 Q418 K419 K423 G424	M223-F421 HydrophobicContact CG-CD1 4.03Å; M223-F421 HydrophobicContact CG-CE1 4.41Å; M223-F421 HydrophobicContact CG-CG 4.29Å; K417-F421 PolarHBondContact O-N 3.31Å; Q418-F421 PolarHBondContact O-N 3.17Å; K419-F421 VanDerWaalsContact C-N 3.34Å; F421-K423 PolarHBondContact O-N 3.37Å; F421-K423 VanDerWaalsContact O-N 3.15Å; F421-G424 PolarHBondContact O-N 2.88Å
422	Q	72.7	Confident	78.3	Confident	44 Å²	44	85 Å²	85	21%	0.206	47%	0.474	C	S	.	.	H	α-helix	trans	-55.3	-31.4	178.4	-80.7	178	-7.4	0	0	113.5	C109 Q418 K419 G424 L427	C109-Q422 PolarHBondContact O-NE2 3.49Å; C109-Q422 VanDerWaalsContact O-NE2 3.16Å; Q418-Q422 WeakPolarHBondContact O-CB 3.35Å; Q418-Q422 WeakPolarHBondContact O-CG 3.5Å; Q418-Q422 PolarHBondContact O-N 2.72Å; K419-Q422 WeakPolarHBondContact O-CB 3.37Å; K419-Q422 PolarHBondContact O-N 2.82Å; Q422-G424 PolarHBondContact O-N 3.25Å; Q422-L427 HydrophobicContact CB-CD1 3.4Å; Q422-L427 VanDerWaalsContact CB-CD1 3.4Å; Q422-L427 HydrophobicContact CB-CD2 4.36Å; Q422-L427 HydrophobicContact CB-CG 4.4Å; Q422-L427 HydrophobicContact CG-CD1 3.43Å; Q422-L427 VanDerWaalsContact CG-CD1 3.43Å; Q422-L427 HydrophobicContact CG-CD2 3.78Å; Q422-L427 HydrophobicContact CG-CG 4.21Å
423	K	72.4	Confident	77.5	Confident	179 Å²	179	87.2 Å²	87.2	78%	0.778	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-17.2	175.6	-71.7	176.6	-178.7	-178.2	0	114.2	K419 L420 F421	K419-K423 PolarHBondContact O-N 3.07Å; L420-K423 PolarHBondContact O-N 3.25Å; F421-K423 PolarHBondContact O-N 3.37Å; F421-K423 VanDerWaalsContact O-N 3.15Å
424	G	67.1	Low	76.5	Confident	69 Å²	69	90.8 Å²	90.8	71%	0.711	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	7.9	-177	0	0	0	0	0	115	F421 Q422	F421-G424 PolarHBondContact O-N 2.88Å; Q422-G424 PolarHBondContact O-N 3.25Å
425	T	69.4	Low	75.4	Confident	63 Å²	63	95.2 Å²	95.2	39%	0.387	54%	0.535	S	S	.	.	S	Bend	trans	-140.2	148.8	-173.4	-52.7	0	0	0	0	111	L427	T425-L427 PolarHBondContact O-N 3.11Å
426	M	72.6	Confident	74.4	Confident	167 Å²	167	96.2 Å²	96.2	82%	0.823	54%	0.544	S	S	*	.			trans	-68.6	126.8	170.6	-71.9	-174.7	75.5	0	0	110
427	L	77.9	Confident	73.3	Confident	54 Å²	54	97.1 Å²	97.1	28%	0.283	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.1	151.3	-176.7	-58.1	168.2	0	0	0	110.9	C109 Q422 T425	C109-L427 HydrophobicContact CB-CB 4.37Å; C109-L427 HydrophobicContact CB-CD1 4.2Å; Q422-L427 HydrophobicContact CB-CD1 3.4Å; Q422-L427 VanDerWaalsContact CB-CD1 3.4Å; Q422-L427 HydrophobicContact CB-CD2 4.36Å; Q422-L427 HydrophobicContact CB-CG 4.4Å; Q422-L427 HydrophobicContact CG-CD1 3.43Å; Q422-L427 VanDerWaalsContact CG-CD1 3.43Å; Q422-L427 HydrophobicContact CG-CD2 3.78Å; Q422-L427 HydrophobicContact CG-CG 4.21Å; T425-L427 PolarHBondContact O-N 3.11Å
428	T	74.8	Confident	72.2	Confident	68 Å²	68	100.1 Å²	100.1	42%	0.417	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	115	160.3	-58.4	0	0	0	0	108.5	V110 E112 K115	V110-T428 PolarHBondContact N-O 3.47Å; V110-T428 PolarHBondContact O-N 3.23Å; E112-T428 PolarHBondContact OE1-OG1 3.15Å; K115-T428 PolarHBondContact NZ-OG1 3.43Å
429	C	78.9	Confident	71.2	Confident	58 Å²	58	105.1 Å²	105.1	39%	0.392	61%	0.608	S	S	.	*			trans	-103.9	146	170.9	-54	0	0	0	0	108.6	C109 K431	C109-C429 HydrophobicContact CB-CB 4.09Å; C109-C429 WeakPolarHBondContact CB-SG 3.32Å; C109-C429 WeakPolarHBondContact SG-CB 3.33Å; C109-C429 CovalentContact SG-SG 2.04Å; C109-C429 PolarHBondContact SG-SG 3.29Å; C429-K431 PolarHBondContact O-N 2.91Å
430	P	68.3	Low	70.1	Confident	74 Å²	74	104.2 Å²	104.2	48%	0.481	62%	0.615	S	S	.	*			trans	-54.7	136.3	167.3	18.1	-25.1	0	0	0	109.8	D106 L108 G432	D106-P430 WeakPolarHBondContact O-CG 3.46Å; L108-P430 WeakPolarHBondContact O-CD 3.43Å; P430-G432 PolarHBondContact O-N 2.66Å
431	K	53.8	Low	68.9	Low	208 Å²	208	103.3 Å²	103.3	90%	0.904	62%	0.616	S	S	*	*			trans	-72.9	114.2	170.9	-67.3	-176.6	179.7	-179.5	0	106.2	C429	C429-K431 PolarHBondContact O-N 2.91Å
432	G	46	Very low	68.5	Low	151 Å²	151	103.2 Å²	103.2	100%	1.557	63%	0.631	S	S	*	*			trans	-60.1	0	-174.3	0	0	0	0	0	115	P430	P430-G432 PolarHBondContact O-N 2.66Å

Retrieved 432 of 432 residues in 561.9 ms (Link to these results)

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