A0A087X2V1_POEFO Loading...

DNA-directed DNA/RNA polymerase mu

Gap-filling polymerase involved in repair of DNA double-strand breaks by non-homologous end joining (NHEJ).

AlphaFold DB , UniProt , Accession A0A087X2V1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 473 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	37.2	Very low	39	Very low	233 Å²	233	163.5 Å²	163.5	100%	1.148	88%	0.884	S	S	*	*				0	117	0	-76.7	-179.8	-168.3	0	0	108.4
2	F	38.7	Very low	38.5	Very low	207 Å²	207	167.5 Å²	167.5	91%	0.908	89%	0.887	S	S	*	*			trans	9.6	108.1	163.5	-58.7	-82.6	0	0	0	120.4
3	H	38	Very low	37.8	Very low	196 Å²	196	173.8 Å²	173.8	91%	0.907	89%	0.891	S	S	*	*	P	Polyproline II helix	trans	-91.5	118	144.7	-85.2	-57.3	0	0	0	108.5
4	A	37.8	Very low	37.3	Very low	99 Å²	99	169.6 Å²	169.6	82%	0.818	89%	0.885	S	S	*	*	P	Polyproline II helix	trans	-94.8	128.3	170	0	0	0	0	0	109.6
5	P	43.3	Very low	37.5	Very low	129 Å²	129	171.3 Å²	171.3	84%	0.838	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-93	157.4	-176.2	34.5	-31.5	0	0	0	113.6
6	A	41	Very low	37.1	Very low	102 Å²	102	168.4 Å²	168.4	84%	0.843	88%	0.878	S	S	*	*	P	Polyproline II helix	trans	-61.6	140.7	-180	0	0	0	0	0	114
7	A	41.3	Very low	36.7	Very low	96 Å²	96	163 Å²	163	79%	0.793	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-77.7	143.5	175.7	0	0	0	0	0	112.4
8	P	40.5	Very low	36.7	Very low	124 Å²	124	164.3 Å²	164.3	81%	0.805	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-87.6	146.8	-175.8	28.1	-22.7	0	0	0	114.1
9	R	39.6	Very low	36.3	Very low	239 Å²	239	164.4 Å²	164.4	90%	0.902	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-66.8	134.9	170.3	-67.6	176.5	175.8	179.6	-2	111.1
10	P	36.7	Very low	36.6	Very low	130 Å²	130	161.8 Å²	161.8	84%	0.844	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-79.1	138.9	172	29.1	-29.7	0	0	0	112.3
11	R	34.5	Very low	36.3	Very low	244 Å²	244	159.7 Å²	159.7	92%	0.921	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-73.5	152.1	179.9	-81.6	173	159.3	175.3	-6.3	113
12	K	33.2	Very low	36.3	Very low	211 Å²	211	154.1 Å²	154.1	92%	0.917	85%	0.845	S	S	*	*			trans	-40.5	135.4	167.8	-85.2	173.4	166.2	175	0	114.1
13	R	30.4	Very low	36.2	Very low	250 Å²	250	154.5 Å²	154.5	94%	0.943	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-93.6	135.4	153.8	-97.1	178.8	169	175.4	-3.9	109.8
14	S	30.6	Very low	36.4	Very low	114 Å²	114	156.5 Å²	156.5	80%	0.797	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-77.2	147.8	178.4	41.9	0	0	0	0	112.6
15	K	39.5	Very low	37	Very low	196 Å²	196	159.3 Å²	159.3	85%	0.852	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-57.6	148.2	175	-74	179.9	169	-173	0	112.8
16	P	32.2	Very low	37.7	Very low	124 Å²	124	161.1 Å²	161.1	81%	0.805	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-100.4	133.5	147.4	9.3	10.6	0	0	0	111.3
17	G	30.4	Very low	39.1	Very low	77 Å²	77	157.7 Å²	157.7	79%	0.794	81%	0.806	S	S	*	*			trans	31.4	116.9	149.3	0	0	0	0	0	120.8	D19	G17-D19 PolarHBondContact O-N 3.48Å
18	E	36.3	Very low	41.1	Very low	187 Å²	187	158.2 Å²	158.2	87%	0.874	80%	0.799	S	S	*	*			trans	-62.1	118.4	149.7	-74	170.8	158.5	0	0	109.3
19	D	29.6	Very low	43.4	Very low	165 Å²	165	154.7 Å²	154.7	88%	0.882	77%	0.771	S	S	*	*			trans	-114	103	147.7	-90.3	-34.4	0	0	0	107.2	G17 V21	G17-D19 PolarHBondContact O-N 3.48Å; D19-V21 PolarHBondContact O-N 3.28Å
20	S	40.9	Very low	45.5	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	75%	0.753	S	S	*	*			trans	-67.1	106.5	172.3	54	0	0	0	0	110.1
21	V	30.6	Very low	47.9	Very low	118 Å²	118	149.5 Å²	149.5	72%	0.715	75%	0.751	S	S	*	*			trans	-130	94	152.7	-173.9	0	0	0	0	107.1	D19 R23	D19-V21 PolarHBondContact O-N 3.28Å; V21-R23 HydrophobicContact CG1-CG 4.25Å; V21-R23 PolarHBondContact O-N 3.2Å
22	S	38.4	Very low	50.5	Low	115 Å²	115	138.8 Å²	138.8	80%	0.804	71%	0.712	S	S	*	*			trans	-66.8	82.4	168.1	60	0	0	0	0	109.2	R24	S22-R24 VanDerWaalsContact C-N 3.32Å; S22-R24 PolarHBondContact O-N 3.47Å; S22-R24 VanDerWaalsContact O-N 3.13Å
23	R	36.2	Very low	53.4	Low	215 Å²	215	132.8 Å²	132.8	81%	0.811	68%	0.684	S	S	*	*			trans	-72.2	97.5	155.4	-77.3	-175.1	178.5	178.9	-0.2	106	V21 E25	V21-R23 HydrophobicContact CG1-CG 4.25Å; V21-R23 PolarHBondContact O-N 3.2Å; R23-E25 PolarHBondContact O-N 3.06Å
24	R	41.1	Very low	56.4	Low	238 Å²	238	120.9 Å²	120.9	90%	0.898	64%	0.639	S	S	*	*			trans	-61.9	95.2	155.6	-83.3	-178.6	174.5	-178.6	-1.8	105.1	S22 E26	S22-R24 VanDerWaalsContact C-N 3.32Å; S22-R24 PolarHBondContact O-N 3.47Å; S22-R24 VanDerWaalsContact O-N 3.13Å; R24-E26 PolarHBondContact O-N 2.64Å; R24-E26 VanDerWaalsContact O-N 3.07Å
25	E	50.7	Low	59.5	Low	158 Å²	158	116 Å²	116	74%	0.738	60%	0.604	S	S	*	*			trans	-58	111.9	163.6	-72.7	179	165	0	0	105.9	R23 A27	R23-E25 PolarHBondContact O-N 3.06Å; E25-A27 PolarHBondContact O-N 3.38Å
26	E	58.7	Low	62	Low	167 Å²	167	106.7 Å²	106.7	78%	0.78	56%	0.563	S	S	*	*			trans	-57.4	128.1	171.1	-74.7	-180	160.8	0	0	107.4	R24 T28	R24-E26 PolarHBondContact O-N 2.64Å; R24-E26 VanDerWaalsContact O-N 3.07Å; E26-T28 PolarHBondContact O-N 3.38Å
27	A	70	Confident	64.9	Low	31 Å²	31	100.8 Å²	100.8	26%	0.256	53%	0.525	S	S	.	.			trans	-58.5	125.3	-177.6	0	0	0	0	0	109.9	E25 F29 Q30 V59	E25-A27 PolarHBondContact O-N 3.38Å; A27-F29 VanDerWaalsContact C-N 3.33Å; A27-F29 PolarHBondContact O-N 3.3Å; A27-Q30 WeakPolarHBondContact O-CG 3.41Å; A27-Q30 PolarHBondContact O-NE2 3.1Å; A27-V59 HydrophobicContact CB-CG2 3.39Å
28	T	83.8	Confident	67.7	Low	106 Å²	106	100.1 Å²	100.1	65%	0.65	50%	0.501	S	S	*	.	S	Bend	trans	-68	-31.3	-176.1	-42.9	0	0	0	0	112.6	E26 G57	E26-T28 PolarHBondContact O-N 3.38Å; T28-G57 PolarHBondContact N-O 3.43Å
29	F	88.1	Confident	69.9	Low	50 Å²	50	95.3 Å²	95.3	22%	0.219	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	68.1	-174.4	-53.1	-64.3	0	0	0	111.7	A27 D31 V32 K56 G57 F58 R112 P113	A27-F29 VanDerWaalsContact C-N 3.33Å; A27-F29 PolarHBondContact O-N 3.3Å; F29-D31 VanDerWaalsContact C-N 3.27Å; F29-D31 PolarHBondContact O-N 3.28Å; F29-V32 PolarHBondContact O-N 3.48Å; F29-K56 WeakPolarHBondContact CE2-O 3.45Å; F29-G57 WeakPolarHBondContact CD2-O 3.47Å; F29-G57 PolarHBondContact N-O 3.37Å; F29-G57 VanDerWaalsContact N-O 3.08Å; F29-F58 HydrophobicContact CD2-CD1 4.33Å; F29-F58 HydrophobicContact CD2-CD2 4.01Å; F29-F58 HydrophobicContact CD2-CE1 4.49Å; F29-F58 HydrophobicContact CD2-CE2 4.14Å; F29-F58 HydrophobicContact CD2-CG 4.12Å; F29-F58 HydrophobicContact CD2-CZ 4.4Å; F29-F58 HydrophobicContact CE2-CD2 4.28Å; F29-F58 HydrophobicContact CE2-CE2 4.06Å; F29-F58 HydrophobicContact CE2-CZ 4.44Å; F29-R112 HydrophobicContact CE1-CB 4.05Å; F29-R112 HydrophobicContact CE2-CB 4.44Å; F29-R112 HydrophobicContact CZ-CB 3.69Å; F29-P113 HydrophobicContact CB-CG 4.03Å; F29-P113 HydrophobicContact CD1-CG 4.03Å; F29-P113 HydrophobicContact CD2-CG 4.33Å; F29-P113 HydrophobicContact CG-CG 3.87Å
30	Q	84.4	Confident	72.5	Confident	111 Å²	111	95.9 Å²	95.9	52%	0.519	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	-24	-175.4	-58.2	-170	9.1	0	0	113.8	A27 V32	A27-Q30 WeakPolarHBondContact O-CG 3.41Å; A27-Q30 PolarHBondContact O-NE2 3.1Å; Q30-V32 VanDerWaalsContact C-N 3.25Å; Q30-V32 PolarHBondContact O-N 2.9Å
31	D	85.4	Confident	74.7	Confident	149 Å²	149	91.2 Å²	91.2	80%	0.797	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	-14.6	178.5	-55.5	-36.9	0	0	0	112.9	F29 T69	F29-D31 VanDerWaalsContact C-N 3.27Å; F29-D31 PolarHBondContact O-N 3.28Å; D31-T69 PolarHBondContact O-OG1 3.42Å
32	V	90.6	Very high	77.4	Confident	19 Å²	19	87.1 Å²	87.1	12%	0.115	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	100.3	-178.4	178.6	0	0	0	0	109.4	F29 Q30 I34 W103 P113	F29-V32 PolarHBondContact O-N 3.48Å; Q30-V32 VanDerWaalsContact C-N 3.25Å; Q30-V32 PolarHBondContact O-N 2.9Å; V32-I34 HydrophobicContact CG1-CG1 4.1Å; V32-W103 HydrophobicContact CG1-CH2 3.86Å; V32-W103 HydrophobicContact CG1-CZ2 4.37Å; V32-P113 HydrophobicContact CB-CB 4.44Å; V32-P113 HydrophobicContact CB-CG 4.02Å; V32-P113 HydrophobicContact CG1-CB 4.28Å; V32-P113 HydrophobicContact CG1-CG 4.18Å; V32-P113 HydrophobicContact CG2-CB 3.93Å; V32-P113 HydrophobicContact CG2-CG 3.82Å
33	R	93.2	Very high	79.9	Confident	85 Å²	85	91 Å²	91	32%	0.321	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	110.5	179.4	-68.4	179.6	176.1	-114.6	8.1	109.6	V59 E61 A67 T69 H70	R33-V59 HydrophobicContact CG-CB 4.08Å; R33-V59 HydrophobicContact CG-CG1 3.93Å; R33-E61 HydrophobicContact CB-CG 4.26Å; R33-E61 IonicContact CZ-OE1 3.79Å; R33-E61 IonicContact NH1-OE1 3.65Å; R33-E61 PolarHBondContact NH1-OE1 3.42Å; R33-A67 WeakPolarHBondContact CB-O 3.06Å; R33-A67 WeakPolarHBondContact CD-O 2.98Å; R33-T69 PolarHBondContact N-OG1 3.1Å; R33-T69 PolarHBondContact O-N 3.44Å; R33-H70 PolarHBondContact O-N 3.41Å
34	I	94.8	Very high	82.5	Confident	0 Å²	0	85.8 Å²	85.8	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.2	-172.8	-58.4	174.3	0	0	0	109.8	V32 L36 F58 V59 V60 E61 H70 V72 W103 F104	V32-I34 HydrophobicContact CG1-CG1 4.1Å; I34-L36 HydrophobicContact CG2-CD2 3.76Å; I34-L36 HydrophobicContact CG2-CG 4.2Å; I34-F58 HydrophobicContact CD1-CB 4.28Å; I34-F58 HydrophobicContact CD1-CD1 3.6Å; I34-F58 HydrophobicContact CD1-CE1 4.28Å; I34-F58 HydrophobicContact CD1-CG 4.27Å; I34-V59 PolarHBondContact N-O 3.43Å; I34-V60 HydrophobicContact CB-CG2 4.46Å; I34-V60 CarbonylContact O-C 3.51Å; I34-V60 VanDerWaalsContact O-CA 3.29Å; I34-V60 WeakPolarHBondContact O-CA 3.38Å; I34-E61 PolarHBondContact O-N 2.9Å; I34-H70 CarbonylContact C-O 3.54Å; I34-H70 VanDerWaalsContact CA-O 3.31Å; I34-H70 WeakPolarHBondContact CA-O 3.35Å; I34-H70 HydrophobicContact CG1-CB 4.38Å; I34-V72 HydrophobicContact CG2-CG2 4Å; I34-W103 HydrophobicContact CD1-CH2 4.01Å; I34-W103 HydrophobicContact CD1-CZ3 3.82Å; I34-W103 HydrophobicContact CG1-CH2 4.26Å; I34-W103 HydrophobicContact CG1-CZ3 4.15Å; I34-F104 HydrophobicContact CD1-CD2 4.38Å; I34-F104 HydrophobicContact CD1-CE2 4.45Å
35	F	94.3	Very high	85	Confident	12 Å²	12	79.4 Å²	79.4	5%	0.053	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.9	162.6	179.7	-98	0	0	0	109.9	V37 L64 V68 H70 V71 V72 W84	F35-V37 HydrophobicContact CD1-CG2 4.23Å; F35-V37 HydrophobicContact CE1-CG2 4.18Å; F35-L64 HydrophobicContact CB-CD1 4.08Å; F35-L64 HydrophobicContact CD1-CB 4.25Å; F35-L64 HydrophobicContact CD1-CD1 3.77Å; F35-L64 HydrophobicContact CD1-CG 4.47Å; F35-L64 HydrophobicContact CD2-CB 4.09Å; F35-L64 HydrophobicContact CD2-CD1 4.46Å; F35-L64 HydrophobicContact CE1-CB 4.08Å; F35-L64 HydrophobicContact CE1-CD1 4.32Å; F35-L64 HydrophobicContact CE2-CB 3.93Å; F35-L64 VanDerWaalsContact CE2-N 3.27Å; F35-L64 HydrophobicContact CG-CB 4.25Å; F35-L64 HydrophobicContact CG-CD1 3.84Å; F35-L64 HydrophobicContact CZ-CB 3.92Å; F35-V68 HydrophobicContact CB-CB 4.43Å; F35-V68 HydrophobicContact CB-CG1 3.61Å; F35-V68 HydrophobicContact CB-CG2 3.91Å; F35-H70 PolarHBondContact N-O 3.33Å; F35-V71 HydrophobicContact CB-CG2 4.44Å; F35-V71 HydrophobicContact CD1-CG1 4.4Å; F35-V71 WeakPolarHBondContact O-CA 3.48Å; F35-V72 PolarHBondContact O-N 3.34Å; F35-W84 HydrophobicContact CE1-CH2 4.22Å
36	L	93.3	Very high	87.1	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	117.9	178.5	-62.8	180	0	0	0	110.6	I34 E38 M41 R46 L49 V60 V72 F104	I34-L36 HydrophobicContact CG2-CD2 3.76Å; I34-L36 HydrophobicContact CG2-CG 4.2Å; L36-E38 PolarHBondContact O-N 3.38Å; L36-M41 HydrophobicContact CB-CE 4.38Å; L36-M41 HydrophobicContact CB-SD 4.31Å; L36-R46 HydrophobicContact CB-CG 4.1Å; L36-R46 PolarHBondContact O-NE 3.38Å; L36-L49 HydrophobicContact CD1-CB 3.58Å; L36-V60 HydrophobicContact CD1-CG1 4.37Å; L36-V60 HydrophobicContact CG-CG1 4.31Å; L36-V72 HydrophobicContact CD2-CB 3.91Å; L36-V72 HydrophobicContact CD2-CG1 4.31Å; L36-F104 HydrophobicContact CD1-CE2 4.49Å; L36-F104 HydrophobicContact CD2-CD2 3.93Å; L36-F104 HydrophobicContact CD2-CE2 3.98Å
37	V	91.6	Very high	88.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.341	C	S	.	.			trans	-74.4	114.2	179.8	-178.2	0	0	0	0	109.9	F35 R39 M41 V71 V72 L81 W84	F35-V37 HydrophobicContact CD1-CG2 4.23Å; F35-V37 HydrophobicContact CE1-CG2 4.18Å; V37-R39 VanDerWaalsContact C-N 3.3Å; V37-R39 HydrophobicContact CG1-CB 4.07Å; V37-R39 HydrophobicContact CG1-CG 4.43Å; V37-R39 PolarHBondContact O-N 2.83Å; V37-M41 WeakPolarHBondContact O-CB 3.29Å; V37-V71 HydrophobicContact CG2-CG1 3.48Å; V37-V71 VanDerWaalsContact CG2-CG1 3.48Å; V37-V72 WeakPolarHBondContact CG2-O 3.25Å; V37-V72 PolarHBondContact N-O 3.08Å; V37-L81 HydrophobicContact CG1-CD1 4.06Å; V37-L81 HydrophobicContact CG2-CD1 4.34Å; V37-W84 HydrophobicContact CG1-CH2 4.34Å; V37-W84 HydrophobicContact CG1-CZ3 4.05Å; V37-W84 HydrophobicContact CG2-CZ3 4.36Å
38	E	89.2	Confident	90	Very high	63 Å²	63	72.5 Å²	72.5	29%	0.294	35%	0.353	S	S	.	.			trans	-71.3	-21.6	-177.2	-169.4	174.4	126.5	0	0	113.9	L36 K40 M41 G42 R43 R46	L36-E38 PolarHBondContact O-N 3.38Å; E38-K40 PolarHBondContact O-N 3.03Å; E38-M41 PolarHBondContact O-N 3.36Å; E38-G42 PolarHBondContact O-N 2.86Å; E38-R43 HydrophobicContact CG-CG 4.32Å; E38-R43 WeakPolarHBondContact OE1-CG 3.4Å; E38-R43 IonicContact OE1-NE 3.43Å; E38-R43 PolarHBondContact OE1-NE 2.97Å; E38-R46 IonicContact OE2-NH1 3.69Å; E38-R46 PolarHBondContact OE2-NH1 3.3Å
39	R	82.7	Confident	90.5	Very high	87 Å²	87	67.6 Å²	67.6	33%	0.328	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	132.3	179.4	-64.9	176.7	66.4	-147.9	-6.2	109.1	V37 M41 S80	V37-R39 VanDerWaalsContact C-N 3.3Å; V37-R39 HydrophobicContact CG1-CB 4.07Å; V37-R39 HydrophobicContact CG1-CG 4.43Å; V37-R39 PolarHBondContact O-N 2.83Å; R39-M41 PolarHBondContact O-N 2.83Å; R39-S80 PolarHBondContact NH1-O 3.37Å; R39-S80 PolarHBondContact NH2-OG 2.93Å
40	K	83.6	Confident	90.9	Very high	177 Å²	177	65.7 Å²	65.7	77%	0.77	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	-22.6	-173.6	-59.3	-71.7	-173.9	169.5	0	116	E38 D75	E38-K40 PolarHBondContact O-N 3.03Å; K40-D75 HydrophobicContact CB-CB 4.42Å; K40-D75 HydrophobicContact CG-CB 4.16Å
41	M	88.1	Confident	91.4	Very high	14 Å²	14	66.5 Å²	66.5	7%	0.069	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-45.7	173.9	-176.9	-173.3	-67.7	0	0	113.1	L36 V37 E38 R39 R45 R46 L49 E74 I101	L36-M41 HydrophobicContact CB-CE 4.38Å; L36-M41 HydrophobicContact CB-SD 4.31Å; V37-M41 WeakPolarHBondContact O-CB 3.29Å; E38-M41 PolarHBondContact O-N 3.36Å; R39-M41 PolarHBondContact O-N 2.83Å; M41-R45 HydrophobicContact CG-CB 3.83Å; M41-R45 HydrophobicContact CG-CG 3.47Å; M41-R45 VanDerWaalsContact CG-CG 3.47Å; M41-R45 WeakPolarHBondContact O-CB 3.5Å; M41-R45 HydrophobicContact SD-CG 4.46Å; M41-R46 HydrophobicContact SD-CB 3.78Å; M41-R46 HydrophobicContact SD-CG 4.36Å; M41-L49 HydrophobicContact CE-CD1 4.03Å; M41-L49 HydrophobicContact SD-CD1 3.95Å; M41-E74 WeakPolarHBondContact CA-OE2 3.24Å; M41-E74 HydrophobicContact CE-CG 3.99Å; M41-I101 HydrophobicContact CE-CD1 4.24Å
42	G	87.8	Confident	91.8	Very high	32 Å²	32	62 Å²	62	33%	0.33	29%	0.294	S	S	.	.			trans	81.7	153.3	-177.2	0	0	0	0	0	114.8	E38 S44 R45 R46	E38-G42 PolarHBondContact O-N 2.86Å; G42-S44 PolarHBondContact O-N 3.19Å; G42-R45 PolarHBondContact O-N 3.32Å; G42-R46 WeakPolarHBondContact O-CB 3.37Å; G42-R46 PolarHBondContact O-N 2.78Å
43	R	89.9	Confident	92	Very high	196 Å²	196	61.1 Å²	61.1	74%	0.74	29%	0.289	S	S	*	.	H	α-helix	trans	-56.3	-46.2	-173.4	-73.6	-173.4	-176.6	-178.8	2.6	114.3	E38 R45 R46 S47	E38-R43 HydrophobicContact CG-CG 4.32Å; E38-R43 WeakPolarHBondContact OE1-CG 3.4Å; E38-R43 IonicContact OE1-NE 3.43Å; E38-R43 PolarHBondContact OE1-NE 2.97Å; R43-R45 VanDerWaalsContact C-N 3.34Å; R43-R45 PolarHBondContact O-N 3.31Å; R43-R46 PolarHBondContact O-N 3.42Å; R43-S47 WeakPolarHBondContact O-CB 3.41Å; R43-S47 PolarHBondContact O-N 3.23Å
44	S	91.8	Very high	92.1	Very high	107 Å²	107	62.4 Å²	62.4	75%	0.748	29%	0.294	S	S	*	.	H	α-helix	trans	-63	-42.7	-177.2	-52.9	0	0	0	0	111.4	G42 S47 F48	G42-S44 PolarHBondContact O-N 3.19Å; S44-S47 PolarHBondContact O-N 3.23Å; S44-F48 PolarHBondContact O-N 3.41Å; S44-F48 VanDerWaalsContact O-N 3.09Å
45	R	92.9	Very high	92	Very high	103 Å²	103	66.3 Å²	66.3	39%	0.389	32%	0.321	S	S	.	.	H	α-helix	trans	-67.7	-45.7	178.1	-179.2	65.3	178	153	0.5	111.3	M41 G42 R43 S47 F48 L49 E74	M41-R45 HydrophobicContact CG-CB 3.83Å; M41-R45 HydrophobicContact CG-CG 3.47Å; M41-R45 VanDerWaalsContact CG-CG 3.47Å; M41-R45 WeakPolarHBondContact O-CB 3.5Å; M41-R45 HydrophobicContact SD-CG 4.46Å; G42-R45 PolarHBondContact O-N 3.32Å; R43-R45 VanDerWaalsContact C-N 3.34Å; R43-R45 PolarHBondContact O-N 3.31Å; R45-S47 VanDerWaalsContact C-N 3.33Å; R45-S47 PolarHBondContact O-N 3.01Å; R45-F48 PolarHBondContact O-N 3.26Å; R45-L49 HydrophobicContact CG-CD1 4.2Å; R45-L49 WeakPolarHBondContact O-CG 3.4Å; R45-L49 PolarHBondContact O-N 2.99Å; R45-E74 IonicContact NE-OE1 3.35Å; R45-E74 PolarHBondContact NE-OE1 3.3Å; R45-E74 IonicContact NH2-OE1 3.89Å
46	R	94.6	Very high	91.8	Very high	38 Å²	38	69.5 Å²	69.5	14%	0.143	34%	0.335	C	S	.	.	H	α-helix	trans	-56.8	-46.1	175.1	179.4	178.3	169.7	-175.1	4.4	111.9	L36 E38 M41 G42 R43 L49 T50 D62	L36-R46 HydrophobicContact CB-CG 4.1Å; L36-R46 PolarHBondContact O-NE 3.38Å; E38-R46 IonicContact OE2-NH1 3.69Å; E38-R46 PolarHBondContact OE2-NH1 3.3Å; M41-R46 HydrophobicContact SD-CB 3.78Å; M41-R46 HydrophobicContact SD-CG 4.36Å; G42-R46 WeakPolarHBondContact O-CB 3.37Å; G42-R46 PolarHBondContact O-N 2.78Å; R43-R46 PolarHBondContact O-N 3.42Å; R46-L49 PolarHBondContact O-N 3.2Å; R46-T50 WeakPolarHBondContact O-CB 3.46Å; R46-T50 PolarHBondContact O-N 3.37Å; R46-T50 PolarHBondContact O-OG1 3.14Å; R46-D62 PolarHBondContact NH2-O 2.9Å
47	S	93.4	Very high	91.7	Very high	61 Å²	61	69.9 Å²	69.9	43%	0.427	34%	0.339	S	S	.	.	H	α-helix	trans	-61.2	-46.1	178.5	-176.7	0	0	0	0	111.8	R43 S44 R45 T50 Q51	R43-S47 WeakPolarHBondContact O-CB 3.41Å; R43-S47 PolarHBondContact O-N 3.23Å; S44-S47 PolarHBondContact O-N 3.23Å; R45-S47 VanDerWaalsContact C-N 3.33Å; R45-S47 PolarHBondContact O-N 3.01Å; S47-T50 WeakPolarHBondContact O-CB 3.37Å; S47-T50 PolarHBondContact O-N 3.37Å; S47-Q51 WeakPolarHBondContact O-CG 3.43Å; S47-Q51 PolarHBondContact O-N 3.15Å
48	F	95.6	Very high	91.7	Very high	112 Å²	112	70 Å²	70	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-58.6	-49.5	175.9	173.1	-96.2	0	0	0	112.4	S44 R45 T50 Q51 L52	S44-F48 PolarHBondContact O-N 3.41Å; S44-F48 VanDerWaalsContact O-N 3.09Å; R45-F48 PolarHBondContact O-N 3.26Å; F48-T50 VanDerWaalsContact C-N 3.31Å; F48-T50 PolarHBondContact O-N 3.48Å; F48-Q51 PolarHBondContact O-N 3.36Å; F48-L52 HydrophobicContact CE1-CD2 4.38Å; F48-L52 WeakPolarHBondContact O-CB 3.36Å; F48-L52 PolarHBondContact O-N 2.81Å
49	L	96	Very high	92	Very high	4 Å²	4	68.2 Å²	68.2	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-36.3	179.5	-67	178.8	0	0	0	112.1	L36 M41 R45 R46 L52 A53 I101 F104	L36-L49 HydrophobicContact CD1-CB 3.58Å; M41-L49 HydrophobicContact CE-CD1 4.03Å; M41-L49 HydrophobicContact SD-CD1 3.95Å; R45-L49 HydrophobicContact CG-CD1 4.2Å; R45-L49 WeakPolarHBondContact O-CG 3.4Å; R45-L49 PolarHBondContact O-N 2.99Å; R46-L49 PolarHBondContact O-N 3.2Å; L49-L52 PolarHBondContact O-N 3.16Å; L49-A53 WeakPolarHBondContact O-CB 3.47Å; L49-A53 PolarHBondContact O-N 3.19Å; L49-I101 HydrophobicContact CD1-CD1 4.03Å; L49-F104 HydrophobicContact CB-CE1 4.17Å; L49-F104 HydrophobicContact CB-CZ 3.97Å; L49-F104 HydrophobicContact CD2-CD1 4.3Å; L49-F104 HydrophobicContact CD2-CE1 3.63Å; L49-F104 HydrophobicContact CD2-CZ 4.28Å; L49-F104 HydrophobicContact CG-CE1 4.35Å; L49-F104 WeakPolarHBondContact O-CZ 3.37Å
50	T	95.4	Very high	92.5	Very high	9 Å²	9	64.3 Å²	64.3	6%	0.055	32%	0.319	C	S	.	.	H	α-helix	trans	-61.4	-47.7	175.1	-59.9	0	0	0	0	111.2	R46 S47 F48 A53 R54 V60	R46-T50 WeakPolarHBondContact O-CB 3.46Å; R46-T50 PolarHBondContact O-N 3.37Å; R46-T50 PolarHBondContact O-OG1 3.14Å; S47-T50 WeakPolarHBondContact O-CB 3.37Å; S47-T50 PolarHBondContact O-N 3.37Å; F48-T50 VanDerWaalsContact C-N 3.31Å; F48-T50 PolarHBondContact O-N 3.48Å; T50-A53 PolarHBondContact O-N 2.98Å; T50-R54 WeakPolarHBondContact O-CB 3.48Å; T50-R54 VanDerWaalsContact O-CG 3.32Å; T50-R54 WeakPolarHBondContact O-CG 3.47Å; T50-R54 PolarHBondContact O-N 3.06Å; T50-V60 HydrophobicContact CG2-CB 4.09Å; T50-V60 HydrophobicContact CG2-CG1 3.9Å
51	Q	94.8	Very high	92.9	Very high	129 Å²	129	57.9 Å²	57.9	60%	0.603	29%	0.291	S	S	*	.	H	α-helix	trans	-63.6	-42.4	177.2	-71.3	177.8	-4.8	0	0	111.5	S47 F48 R54 S55	S47-Q51 WeakPolarHBondContact O-CG 3.43Å; S47-Q51 PolarHBondContact O-N 3.15Å; F48-Q51 PolarHBondContact O-N 3.36Å; Q51-R54 PolarHBondContact O-N 3.26Å; Q51-S55 WeakPolarHBondContact O-CB 3.49Å; Q51-S55 PolarHBondContact O-N 3.2Å; Q51-S55 PolarHBondContact O-OG 3.46Å
52	L	95.3	Very high	92.9	Very high	55 Å²	55	61.5 Å²	61.5	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-59.7	-50	177.6	178.6	61.2	0	0	0	111.8	F48 L49 S55 K56 M108	F48-L52 HydrophobicContact CE1-CD2 4.38Å; F48-L52 WeakPolarHBondContact O-CB 3.36Å; F48-L52 PolarHBondContact O-N 2.81Å; L49-L52 PolarHBondContact O-N 3.16Å; L52-S55 PolarHBondContact O-N 3.08Å; L52-S55 PolarHBondContact O-OG 2.99Å; L52-K56 HydrophobicContact CD1-CD 4.47Å; L52-K56 PolarHBondContact O-N 3.32Å; L52-M108 HydrophobicContact CD2-CB 4.49Å; L52-M108 HydrophobicContact CD2-CG 4.08Å; L52-M108 HydrophobicContact CG-CG 4.32Å; L52-M108 HydrophobicContact CG-SD 4.16Å
53	A	94.1	Very high	92.9	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.3	-44.6	179	0	0	0	0	0	112.3	L49 T50 S55 K56 G57 F58 V60 F104 M108	L49-A53 WeakPolarHBondContact O-CB 3.47Å; L49-A53 PolarHBondContact O-N 3.19Å; T50-A53 PolarHBondContact O-N 2.98Å; A53-S55 VanDerWaalsContact C-N 3.33Å; A53-S55 PolarHBondContact O-N 3.47Å; A53-K56 CarbonylContact O-C 3.46Å; A53-K56 WeakPolarHBondContact O-CA 3.22Å; A53-K56 PolarHBondContact O-N 3.45Å; A53-G57 PolarHBondContact O-N 3.18Å; A53-F58 HydrophobicContact CB-CB 4.03Å; A53-F58 WeakPolarHBondContact O-CB 3.47Å; A53-F58 PolarHBondContact O-N 2.98Å; A53-F58 VanDerWaalsContact O-N 3.08Å; A53-V60 HydrophobicContact CB-CG2 3.52Å; A53-F104 HydrophobicContact CB-CE2 3.77Å; A53-F104 HydrophobicContact CB-CZ 3.78Å; A53-M108 HydrophobicContact CB-CE 3.89Å; A53-M108 HydrophobicContact CB-SD 4.04Å
54	R	94.4	Very high	92.8	Very high	112 Å²	112	58.3 Å²	58.3	42%	0.423	30%	0.3	S	S	.	.	H	α-helix	trans	-61.4	-40.2	177.1	-73.1	177.1	178.4	168.8	0.9	111.8	T50 Q51 K56 G57 V60 D62	T50-R54 WeakPolarHBondContact O-CB 3.48Å; T50-R54 VanDerWaalsContact O-CG 3.32Å; T50-R54 WeakPolarHBondContact O-CG 3.47Å; T50-R54 PolarHBondContact O-N 3.06Å; Q51-R54 PolarHBondContact O-N 3.26Å; R54-K56 PolarHBondContact O-N 2.9Å; R54-K56 VanDerWaalsContact O-N 3.16Å; R54-G57 PolarHBondContact O-N 3.34Å; R54-V60 HydrophobicContact CG-CB 4.4Å; R54-V60 HydrophobicContact CG-CG2 4.29Å; R54-V60 PolarHBondContact NH2-O 2.84Å; R54-D62 IonicContact CZ-OD2 3.41Å; R54-D62 IonicContact NH1-OD2 3.33Å; R54-D62 IonicContact NH2-OD1 2.92Å; R54-D62 PolarHBondContact NH2-OD1 2.93Å; R54-D62 IonicContact NH2-OD2 3.22Å; R54-D62 PolarHBondContact NH2-OD2 3.45Å
55	S	92.4	Very high	92.6	Very high	82 Å²	82	55.3 Å²	55.3	57%	0.573	28%	0.279	S	S	*	.	H	α-helix	trans	-64.2	-16.6	174.8	74.3	0	0	0	0	114.3	Q51 L52 A53	Q51-S55 WeakPolarHBondContact O-CB 3.49Å; Q51-S55 PolarHBondContact O-N 3.2Å; Q51-S55 PolarHBondContact O-OG 3.46Å; L52-S55 PolarHBondContact O-N 3.08Å; L52-S55 PolarHBondContact O-OG 2.99Å; A53-S55 VanDerWaalsContact C-N 3.33Å; A53-S55 PolarHBondContact O-N 3.47Å
56	K	91.5	Very high	92.1	Very high	78 Å²	78	55.4 Å²	55.4	34%	0.339	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	14.1	175.7	-74.5	175.5	169.4	-90.2	0	112.7	F29 L52 A53 R54 F58 M108	F29-K56 WeakPolarHBondContact CE2-O 3.45Å; L52-K56 HydrophobicContact CD1-CD 4.47Å; L52-K56 PolarHBondContact O-N 3.32Å; A53-K56 CarbonylContact O-C 3.46Å; A53-K56 WeakPolarHBondContact O-CA 3.22Å; A53-K56 PolarHBondContact O-N 3.45Å; R54-K56 PolarHBondContact O-N 2.9Å; R54-K56 VanDerWaalsContact O-N 3.16Å; K56-F58 HydrophobicContact CB-CD2 3.88Å; K56-F58 HydrophobicContact CB-CE2 3.97Å; K56-F58 PolarHBondContact O-N 3.39Å; K56-M108 HydrophobicContact CD-CB 4.46Å; K56-M108 HydrophobicContact CD-SD 3.8Å; K56-M108 VanDerWaalsContact CE-O 3.26Å; K56-M108 WeakPolarHBondContact CE-O 3.37Å; K56-M108 PolarHBondContact NZ-O 3.11Å
57	G	90	Very high	91.7	Very high	9 Å²	9	55.7 Å²	55.7	9%	0.093	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	10.8	175.3	0	0	0	0	0	115.5	T28 F29 A53 R54	T28-G57 PolarHBondContact N-O 3.43Å; F29-G57 WeakPolarHBondContact CD2-O 3.47Å; F29-G57 PolarHBondContact N-O 3.37Å; F29-G57 VanDerWaalsContact N-O 3.08Å; A53-G57 PolarHBondContact O-N 3.18Å; R54-G57 PolarHBondContact O-N 3.34Å
58	F	93	Very high	91.5	Very high	3 Å²	3	53 Å²	53	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	145.5	174.6	-68.1	-105.7	0	0	0	111.4	F29 I34 A53 K56 M108 R112 P113	F29-F58 HydrophobicContact CD2-CD1 4.33Å; F29-F58 HydrophobicContact CD2-CD2 4.01Å; F29-F58 HydrophobicContact CD2-CE1 4.49Å; F29-F58 HydrophobicContact CD2-CE2 4.14Å; F29-F58 HydrophobicContact CD2-CG 4.12Å; F29-F58 HydrophobicContact CD2-CZ 4.4Å; F29-F58 HydrophobicContact CE2-CD2 4.28Å; F29-F58 HydrophobicContact CE2-CE2 4.06Å; F29-F58 HydrophobicContact CE2-CZ 4.44Å; I34-F58 HydrophobicContact CD1-CB 4.28Å; I34-F58 HydrophobicContact CD1-CD1 3.6Å; I34-F58 HydrophobicContact CD1-CE1 4.28Å; I34-F58 HydrophobicContact CD1-CG 4.27Å; A53-F58 HydrophobicContact CB-CB 4.03Å; A53-F58 WeakPolarHBondContact O-CB 3.47Å; A53-F58 PolarHBondContact O-N 2.98Å; A53-F58 VanDerWaalsContact O-N 3.08Å; K56-F58 HydrophobicContact CB-CD2 3.88Å; K56-F58 HydrophobicContact CB-CE2 3.97Å; K56-F58 PolarHBondContact O-N 3.39Å; F58-M108 HydrophobicContact CD1-CE 4.15Å; F58-M108 HydrophobicContact CD2-CE 3.72Å; F58-M108 HydrophobicContact CD2-SD 4.48Å; F58-M108 HydrophobicContact CE1-CE 3.93Å; F58-M108 HydrophobicContact CE2-CE 3.52Å; F58-M108 HydrophobicContact CE2-SD 4.3Å; F58-M108 HydrophobicContact CG-CE 4.02Å; F58-M108 HydrophobicContact CZ-CE 3.61Å; F58-R112 VanDerWaalsContact CZ-C 3.41Å; F58-P113 HydrophobicContact CD1-CG 4.15Å; F58-P113 HydrophobicContact CE1-CB 4.11Å; F58-P113 HydrophobicContact CE1-CG 3.56Å; F58-P113 HydrophobicContact CZ-CG 4.21Å
59	V	94.3	Very high	91.3	Very high	24 Å²	24	49.7 Å²	49.7	15%	0.145	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	118.7	169.6	-175.4	0	0	0	0	108.9	A27 R33 I34	A27-V59 HydrophobicContact CB-CG2 3.39Å; R33-V59 HydrophobicContact CG-CB 4.08Å; R33-V59 HydrophobicContact CG-CG1 3.93Å; I34-V59 PolarHBondContact N-O 3.43Å
60	V	93.8	Very high	91.2	Very high	6 Å²	6	50.3 Å²	50.3	4%	0.036	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	117.5	173.5	-173.4	0	0	0	0	109.2	I34 L36 T50 A53 R54	I34-V60 HydrophobicContact CB-CG2 4.46Å; I34-V60 CarbonylContact O-C 3.51Å; I34-V60 VanDerWaalsContact O-CA 3.29Å; I34-V60 WeakPolarHBondContact O-CA 3.38Å; L36-V60 HydrophobicContact CD1-CG1 4.37Å; L36-V60 HydrophobicContact CG-CG1 4.31Å; T50-V60 HydrophobicContact CG2-CB 4.09Å; T50-V60 HydrophobicContact CG2-CG1 3.9Å; A53-V60 HydrophobicContact CB-CG2 3.52Å; R54-V60 HydrophobicContact CG-CB 4.4Å; R54-V60 HydrophobicContact CG-CG2 4.29Å; R54-V60 PolarHBondContact NH2-O 2.84Å
61	E	92.5	Very high	91.1	Very high	41 Å²	41	49.9 Å²	49.9	19%	0.192	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	132.7	178.9	-62.4	-65.1	169.4	0	0	110.5	R33 I34 I63 V68	R33-E61 HydrophobicContact CB-CG 4.26Å; R33-E61 IonicContact CZ-OE1 3.79Å; R33-E61 IonicContact NH1-OE1 3.65Å; R33-E61 PolarHBondContact NH1-OE1 3.42Å; I34-E61 PolarHBondContact O-N 2.9Å; E61-I63 VanDerWaalsContact C-N 3.32Å; E61-V68 HydrophobicContact CB-CG2 3.94Å; E61-V68 HydrophobicContact CG-CG2 3.89Å
62	D	87.7	Confident	91	Very high	91 Å²	91	43.7 Å²	43.7	49%	0.487	24%	0.239	S	C	.	.	S	Bend	trans	-79.5	-21.4	178.3	-69.8	-53.3	0	0	0	112	R46 R54	R46-D62 PolarHBondContact NH2-O 2.9Å; R54-D62 IonicContact CZ-OD2 3.41Å; R54-D62 IonicContact NH1-OD2 3.33Å; R54-D62 IonicContact NH2-OD1 2.92Å; R54-D62 PolarHBondContact NH2-OD1 2.93Å; R54-D62 IonicContact NH2-OD2 3.22Å; R54-D62 PolarHBondContact NH2-OD2 3.45Å
63	I	88.3	Confident	90.8	Very high	133 Å²	133	41.1 Å²	41.1	68%	0.682	23%	0.225	S	C	*	.	S	Bend	trans	-126.1	135.9	-178.2	-54.7	175.2	0	0	0	108.7	E61 S65	E61-I63 VanDerWaalsContact C-N 3.32Å; I63-S65 PolarHBondContact O-N 3.36Å
64	L	86.9	Confident	90.6	Very high	27 Å²	27	43.9 Å²	43.9	14%	0.141	24%	0.238	C	C	.	.			trans	-68.1	119.2	172.5	-172.5	61.5	0	0	0	108.5	F35 V68 V71 L85 R88 L90	F35-L64 HydrophobicContact CB-CD1 4.08Å; F35-L64 HydrophobicContact CD1-CB 4.25Å; F35-L64 HydrophobicContact CD1-CD1 3.77Å; F35-L64 HydrophobicContact CD1-CG 4.47Å; F35-L64 HydrophobicContact CD2-CB 4.09Å; F35-L64 HydrophobicContact CD2-CD1 4.46Å; F35-L64 HydrophobicContact CE1-CB 4.08Å; F35-L64 HydrophobicContact CE1-CD1 4.32Å; F35-L64 HydrophobicContact CE2-CB 3.93Å; F35-L64 VanDerWaalsContact CE2-N 3.27Å; F35-L64 HydrophobicContact CG-CB 4.25Å; F35-L64 HydrophobicContact CG-CD1 3.84Å; F35-L64 HydrophobicContact CZ-CB 3.92Å; L64-V68 HydrophobicContact CD1-CB 4.27Å; L64-V68 HydrophobicContact CD1-CG1 4.17Å; L64-V68 HydrophobicContact CD1-CG2 4.22Å; L64-V71 HydrophobicContact CD1-CG2 3.76Å; L64-L85 HydrophobicContact CD2-CD2 3.96Å; L64-R88 HydrophobicContact CD2-CB 4.02Å; L64-L90 HydrophobicContact CD1-CD1 3.95Å; L64-L90 HydrophobicContact CD1-CD2 4.42Å; L64-L90 HydrophobicContact CD2-CD1 3.83Å; L64-L90 HydrophobicContact CD2-CG 4.3Å; L64-L90 HydrophobicContact CG-CD1 3.87Å; L64-L90 HydrophobicContact CG-CD2 4.12Å; L64-L90 HydrophobicContact CG-CG 4.14Å
65	S	87	Confident	89.8	Confident	45 Å²	45	39.1 Å²	39.1	32%	0.315	22%	0.221	S	C	.	.			trans	-144.8	168.9	-178	66.4	0	0	0	0	110.1	I63 A67 V68 L90	I63-S65 PolarHBondContact O-N 3.36Å; S65-A67 PolarHBondContact O-N 3.27Å; S65-V68 WeakPolarHBondContact O-CB 3.44Å; S65-V68 WeakPolarHBondContact O-CG2 3.42Å; S65-V68 PolarHBondContact O-N 3.09Å; S65-L90 VanDerWaalsContact C-CD2 3.46Å; S65-L90 WeakPolarHBondContact O-CD2 3.37Å
66	D	83.9	Confident	88.7	Confident	104 Å²	104	39.2 Å²	39.2	56%	0.556	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.6	179.1	-66.1	-28	0	0	0	113.8	V68 S91	D66-V68 VanDerWaalsContact C-N 3.31Å; D66-S91 VanDerWaalsContact CG-OG 3.3Å; D66-S91 PolarHBondContact OD1-N 2.82Å; D66-S91 PolarHBondContact OD1-OG 2.99Å; D66-S91 PolarHBondContact OD2-OG 2.92Å
67	A	84.9	Confident	87.6	Confident	45 Å²	45	41.6 Å²	41.6	37%	0.372	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-16.4	171.9	0	0	0	0	0	113	R33 S65 T69	R33-A67 WeakPolarHBondContact CB-O 3.06Å; R33-A67 WeakPolarHBondContact CD-O 2.98Å; S65-A67 PolarHBondContact O-N 3.27Å; A67-T69 PolarHBondContact O-N 2.82Å
68	V	90.6	Very high	86.5	Confident	3 Å²	3	43 Å²	43	2%	0.018	24%	0.242	C	C	.	.			trans	-73.3	125.1	-177.4	173.9	0	0	0	0	110.1	F35 E61 L64 S65 D66 H70 V71 V96	F35-V68 HydrophobicContact CB-CB 4.43Å; F35-V68 HydrophobicContact CB-CG1 3.61Å; F35-V68 HydrophobicContact CB-CG2 3.91Å; E61-V68 HydrophobicContact CB-CG2 3.94Å; E61-V68 HydrophobicContact CG-CG2 3.89Å; L64-V68 HydrophobicContact CD1-CB 4.27Å; L64-V68 HydrophobicContact CD1-CG1 4.17Å; L64-V68 HydrophobicContact CD1-CG2 4.22Å; S65-V68 WeakPolarHBondContact O-CB 3.44Å; S65-V68 WeakPolarHBondContact O-CG2 3.42Å; S65-V68 PolarHBondContact O-N 3.09Å; D66-V68 VanDerWaalsContact C-N 3.31Å; V68-H70 WeakPolarHBondContact CG1-O 3.49Å; V68-V71 HydrophobicContact CG1-CG2 3.84Å; V68-V96 WeakPolarHBondContact O-CG2 3.35Å
69	T	91.1	Very high	85.4	Confident	43 Å²	43	46.3 Å²	46.3	26%	0.264	27%	0.266	S	S	.	.			trans	-99.9	-23.5	175.9	59.5	0	0	0	0	112.6	D31 R33 A67 N97	D31-T69 PolarHBondContact O-OG1 3.42Å; R33-T69 PolarHBondContact N-OG1 3.1Å; R33-T69 PolarHBondContact O-N 3.44Å; A67-T69 PolarHBondContact O-N 2.82Å; T69-N97 PolarHBondContact O-N 2.95Å
70	H	93.4	Very high	84.5	Confident	17 Å²	17	46.7 Å²	46.7	8%	0.079	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	117.4	-176.4	-64.7	64	0	0	0	110.5	R33 I34 F35 V68 N97 L99 W103	R33-H70 PolarHBondContact O-N 3.41Å; I34-H70 CarbonylContact C-O 3.54Å; I34-H70 VanDerWaalsContact CA-O 3.31Å; I34-H70 WeakPolarHBondContact CA-O 3.35Å; I34-H70 HydrophobicContact CG1-CB 4.38Å; F35-H70 PolarHBondContact N-O 3.33Å; V68-H70 WeakPolarHBondContact CG1-O 3.49Å; H70-N97 CarbonylContact C-O 3.58Å; H70-N97 WeakPolarHBondContact CA-O 3.41Å; H70-N97 PolarHBondContact NE2-ND2 3.46Å; H70-L99 HydrophobicContact CB-CD1 4.35Å; H70-L99 VanDerWaalsContact CD2-CD1 3.5Å; H70-L99 WeakPolarHBondContact CD2-CD1 3.33Å; H70-W103 HydrophobicContact CB-CH2 4.38Å; H70-W103 HydrophobicContact CB-CZ3 4.42Å; H70-W103 AromaticContact CD2-CE2 3.99Å; H70-W103 AromaticContact CD2-CH2 3.59Å; H70-W103 AromaticContact CD2-CZ2 3.49Å; H70-W103 VanDerWaalsContact CD2-CZ2 3.49Å; H70-W103 WeakPolarHBondContact CD2-CZ2 3.49Å; H70-W103 AromaticContact NE2-CZ2 3.86Å
71	V	92.7	Very high	84	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.7	172.2	172.7	0	0	0	0	107.9	F35 V37 L64 V68 L85 V96 N97 V98 L99	F35-V71 HydrophobicContact CB-CG2 4.44Å; F35-V71 HydrophobicContact CD1-CG1 4.4Å; F35-V71 WeakPolarHBondContact O-CA 3.48Å; V37-V71 HydrophobicContact CG2-CG1 3.48Å; V37-V71 VanDerWaalsContact CG2-CG1 3.48Å; L64-V71 HydrophobicContact CD1-CG2 3.76Å; V68-V71 HydrophobicContact CG1-CG2 3.84Å; V71-L85 HydrophobicContact CG1-CD1 4.41Å; V71-L85 HydrophobicContact CG1-CD2 3.99Å; V71-V96 HydrophobicContact CB-CG1 4.37Å; V71-V96 HydrophobicContact CG2-CG1 3.66Å; V71-N97 PolarHBondContact N-O 3.36Å; V71-V98 HydrophobicContact CB-CG2 4.42Å; V71-V98 HydrophobicContact CG1-CG1 4.5Å; V71-V98 WeakPolarHBondContact O-CA 3.47Å; V71-L99 PolarHBondContact O-N 2.67Å
72	V	93	Very high	83.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.2	-178.3	-179.2	0	0	0	0	110.1	I34 F35 L36 V37 L99 I101 W103 F104	I34-V72 HydrophobicContact CG2-CG2 4Å; F35-V72 PolarHBondContact O-N 3.34Å; L36-V72 HydrophobicContact CD2-CB 3.91Å; L36-V72 HydrophobicContact CD2-CG1 4.31Å; V37-V72 WeakPolarHBondContact CG2-O 3.25Å; V37-V72 PolarHBondContact N-O 3.08Å; V72-L99 WeakPolarHBondContact CA-O 3.3Å; V72-L99 HydrophobicContact CG2-CB 4.41Å; V72-I101 HydrophobicContact CG1-CD1 3.87Å; V72-W103 HydrophobicContact CG2-CE3 3.86Å; V72-W103 HydrophobicContact CG2-CZ3 4.03Å; V72-F104 HydrophobicContact CG1-CB 3.88Å; V72-F104 HydrophobicContact CG2-CB 4.47Å
73	S	90.9	Very high	83	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.9	-178.9	-176.7	0	0	0	0	111.4	D75 L99 D100 I101	S73-D75 VanDerWaalsContact C-N 3.34Å; S73-D75 WeakPolarHBondContact OG-CB 3.3Å; S73-D75 PolarHBondContact OG-N 3.2Å; S73-D75 PolarHBondContact OG-O 3.15Å; S73-L99 PolarHBondContact N-O 3.2Å; S73-D100 CarbonylContact O-C 3.6Å; S73-I101 PolarHBondContact O-N 3.48Å
74	E	89.6	Confident	82.8	Confident	59 Å²	59	41 Å²	41	28%	0.276	24%	0.24	S	C	.	.	S	Bend	trans	-86.1	-10.2	164.8	-74	-178.9	174.5	0	0	111.6	M41 R45 S76 I101	M41-E74 WeakPolarHBondContact CA-OE2 3.24Å; M41-E74 HydrophobicContact CE-CG 3.99Å; R45-E74 IonicContact NE-OE1 3.35Å; R45-E74 PolarHBondContact NE-OE1 3.3Å; R45-E74 IonicContact NH2-OE1 3.89Å; E74-S76 PolarHBondContact O-N 3.29Å; E74-I101 HydrophobicContact CG-CB 3.73Å; E74-I101 HydrophobicContact CG-CD1 3.92Å; E74-I101 HydrophobicContact CG-CG1 3.66Å; E74-I101 HydrophobicContact CG-CG2 4.1Å
75	D	79.4	Confident	82.7	Confident	12 Å²	12	39.8 Å²	39.8	6%	0.064	23%	0.234	C	C	.	.			trans	-84.2	101.6	170.6	-171.9	5	0	0	0	109.8	K40 S73 Q77 S80	K40-D75 HydrophobicContact CB-CB 4.42Å; K40-D75 HydrophobicContact CG-CB 4.16Å; S73-D75 VanDerWaalsContact C-N 3.34Å; S73-D75 WeakPolarHBondContact OG-CB 3.3Å; S73-D75 PolarHBondContact OG-N 3.2Å; S73-D75 PolarHBondContact OG-O 3.15Å; D75-Q77 VanDerWaalsContact C-N 3.26Å; D75-Q77 PolarHBondContact O-N 3.28Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.29Å; D75-Q77 PolarHBondContact OD1-N 3.21Å; D75-S80 PolarHBondContact OD2-OG 2.92Å
76	S	68.3	Low	82.3	Confident	84 Å²	84	42.8 Å²	42.8	59%	0.587	24%	0.241	S	C	*	.			trans	-80.3	-2	176	55.9	0	0	0	0	113.5	E74 S78	E74-S76 PolarHBondContact O-N 3.29Å; S76-S78 PolarHBondContact O-N 3.42Å
77	Q	69.3	Low	82.1	Confident	127 Å²	127	41.7 Å²	41.7	59%	0.593	24%	0.242	S	C	*	.			trans	-85.2	105.8	176.9	-61.1	-171.9	-9.4	0	0	111.5	D75 S79 S80 L81	D75-Q77 VanDerWaalsContact C-N 3.26Å; D75-Q77 PolarHBondContact O-N 3.28Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.29Å; D75-Q77 PolarHBondContact OD1-N 3.21Å; Q77-S79 PolarHBondContact O-N 3.38Å; Q77-S79 VanDerWaalsContact O-N 3.17Å; Q77-S80 PolarHBondContact O-N 2.95Å; Q77-L81 PolarHBondContact O-N 2.83Å
78	S	66.7	Low	81.6	Confident	38 Å²	38	46.7 Å²	46.7	27%	0.266	25%	0.251	S	S	.	.	H	α-helix	trans	-58.1	-29.3	179.7	57	0	0	0	0	114.2	S76 S80 W82 Q123	S76-S78 PolarHBondContact O-N 3.42Å; S78-S80 VanDerWaalsContact C-N 3.26Å; S78-S80 PolarHBondContact O-N 3.25Å; S78-W82 PolarHBondContact O-N 3Å; S78-Q123 WeakPolarHBondContact CB-O 3.15Å
79	S	68.8	Low	80	Confident	74 Å²	74	51.7 Å²	51.7	52%	0.517	29%	0.286	S	S	.	.	H	α-helix	trans	-66.2	-21.4	-178.2	57.7	0	0	0	0	115.5	Q77	Q77-S79 PolarHBondContact O-N 3.38Å; Q77-S79 VanDerWaalsContact O-N 3.17Å
80	S	75.9	Confident	78.8	Confident	32 Å²	32	50.9 Å²	50.9	22%	0.224	28%	0.28	C	S	.	.	H	α-helix	trans	-105.4	-33.2	-178.9	134.7	0	0	0	0	112	R39 D75 Q77 S78	R39-S80 PolarHBondContact NH1-O 3.37Å; R39-S80 PolarHBondContact NH2-OG 2.93Å; D75-S80 PolarHBondContact OD2-OG 2.92Å; Q77-S80 PolarHBondContact O-N 2.95Å; S78-S80 VanDerWaalsContact C-N 3.26Å; S78-S80 PolarHBondContact O-N 3.25Å
81	L	82.3	Confident	77.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-79.2	-48.4	-172.6	-177.1	63.5	0	0	0	112.5	V37 Q77 W84 L85 V98 I122	V37-L81 HydrophobicContact CG1-CD1 4.06Å; V37-L81 HydrophobicContact CG2-CD1 4.34Å; Q77-L81 PolarHBondContact O-N 2.83Å; L81-W84 HydrophobicContact CD1-CE3 4.46Å; L81-W84 WeakPolarHBondContact O-CB 3.36Å; L81-W84 PolarHBondContact O-N 3.13Å; L81-L85 HydrophobicContact CD1-CD1 4.26Å; L81-L85 HydrophobicContact CD1-CG 4.34Å; L81-L85 HydrophobicContact CD2-CD1 4.47Å; L81-L85 HydrophobicContact CG-CD1 3.93Å; L81-L85 HydrophobicContact CG-CG 4.4Å; L81-L85 WeakPolarHBondContact O-CG 3.22Å; L81-L85 PolarHBondContact O-N 2.88Å; L81-V98 HydrophobicContact CD2-CG1 3.85Å; L81-I122 HydrophobicContact CD2-CB 4.47Å; L81-I122 HydrophobicContact CD2-CD1 3.65Å; L81-I122 HydrophobicContact CD2-CG2 4.03Å
82	W	80.1	Confident	76	Confident	22 Å²	22	58.5 Å²	58.5	8%	0.083	33%	0.329	C	S	.	.	H	α-helix	trans	-67.3	-43.3	-173.4	-75.5	100.6	0	0	0	114.7	S78 W84 L85 K86 V98 I122 Q123 D124	S78-W82 PolarHBondContact O-N 3Å; W82-W84 PolarHBondContact O-N 2.8Å; W82-L85 HydrophobicContact CE3-CD1 4.4Å; W82-L85 PolarHBondContact O-N 2.87Å; W82-K86 WeakPolarHBondContact O-CB 3.36Å; W82-K86 WeakPolarHBondContact O-CG 3.4Å; W82-K86 PolarHBondContact O-N 3.45Å; W82-V98 HydrophobicContact CH2-CB 3.83Å; W82-V98 HydrophobicContact CH2-CG1 4.47Å; W82-V98 HydrophobicContact CH2-CG2 3.4Å; W82-V98 VanDerWaalsContact CH2-CG2 3.4Å; W82-V98 HydrophobicContact CZ2-CB 3.69Å; W82-V98 HydrophobicContact CZ2-CG1 4.05Å; W82-V98 HydrophobicContact CZ2-CG2 3.8Å; W82-V98 HydrophobicContact CZ3-CG2 3.94Å; W82-I122 WeakPolarHBondContact CZ2-O 3.28Å; W82-I122 PolarHBondContact NE1-O 3.24Å; W82-Q123 VanDerWaalsContact NE1-C 3.26Å; W82-Q123 PolarHBondContact NE1-O 2.74Å; W82-D124 WeakPolarHBondContact CB-OD1 3.35Å; W82-D124 HydrophobicContact CD2-CB 3.66Å; W82-D124 HydrophobicContact CE3-CB 3.93Å; W82-D124 HydrophobicContact CG-CB 4.2Å; W82-D124 VanDerWaalsContact CG-OD1 3.25Å; W82-D124 HydrophobicContact CH2-CB 3.94Å; W82-D124 HydrophobicContact CZ2-CB 3.7Å; W82-D124 HydrophobicContact CZ3-CB 4.06Å; W82-D124 VanDerWaalsContact NE1-CA 3.26Å
83	P	80.8	Confident	74.8	Confident	74 Å²	74	60.1 Å²	60.1	48%	0.481	34%	0.338	S	S	.	.	H	α-helix	trans	-59.2	-34.8	172.3	-24.9	35.3	0	0	0	112.5	S87	P83-S87 PolarHBondContact O-N 3.3Å; P83-S87 VanDerWaalsContact O-N 3.11Å; P83-S87 PolarHBondContact O-OG 3.24Å
84	W	83.9	Confident	73.6	Confident	56 Å²	56	65 Å²	65	21%	0.212	37%	0.371	C	S	.	.	H	α-helix	trans	-71.4	-42	177.3	178.8	88.2	0	0	0	112.1	F35 V37 L81 W82 S87 R88	F35-W84 HydrophobicContact CE1-CH2 4.22Å; V37-W84 HydrophobicContact CG1-CH2 4.34Å; V37-W84 HydrophobicContact CG1-CZ3 4.05Å; V37-W84 HydrophobicContact CG2-CZ3 4.36Å; L81-W84 HydrophobicContact CD1-CE3 4.46Å; L81-W84 WeakPolarHBondContact O-CB 3.36Å; L81-W84 PolarHBondContact O-N 3.13Å; W82-W84 PolarHBondContact O-N 2.8Å; W84-S87 PolarHBondContact O-N 3.48Å; W84-S87 PolarHBondContact O-OG 2.94Å; W84-R88 HydrophobicContact CZ2-CG 4.44Å; W84-R88 WeakPolarHBondContact O-CG 3.21Å
85	L	83.3	Confident	72.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-62.8	-44.3	174.1	-70.8	171.8	0	0	0	111.4	L64 V71 L81 W82 S87 R88 L93 V98	L64-L85 HydrophobicContact CD2-CD2 3.96Å; V71-L85 HydrophobicContact CG1-CD1 4.41Å; V71-L85 HydrophobicContact CG1-CD2 3.99Å; L81-L85 HydrophobicContact CD1-CD1 4.26Å; L81-L85 HydrophobicContact CD1-CG 4.34Å; L81-L85 HydrophobicContact CD2-CD1 4.47Å; L81-L85 HydrophobicContact CG-CD1 3.93Å; L81-L85 HydrophobicContact CG-CG 4.4Å; L81-L85 WeakPolarHBondContact O-CG 3.22Å; L81-L85 PolarHBondContact O-N 2.88Å; W82-L85 HydrophobicContact CE3-CD1 4.4Å; W82-L85 PolarHBondContact O-N 2.87Å; L85-S87 VanDerWaalsContact C-N 3.27Å; L85-S87 PolarHBondContact O-N 3.17Å; L85-R88 PolarHBondContact O-N 3.38Å; L85-L93 HydrophobicContact CB-CD2 4.36Å; L85-V98 HydrophobicContact CD1-CG1 3.85Å; L85-V98 HydrophobicContact CD1-CG2 3.96Å
86	K	79.8	Confident	73	Confident	108 Å²	108	66.9 Å²	66.9	47%	0.47	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-31.8	177.6	-73.4	170.6	178.4	165.4	0	112.9	W82 R88 L93 D124	W82-K86 WeakPolarHBondContact O-CB 3.36Å; W82-K86 WeakPolarHBondContact O-CG 3.4Å; W82-K86 PolarHBondContact O-N 3.45Å; K86-R88 VanDerWaalsContact C-N 3.28Å; K86-R88 PolarHBondContact O-N 3.45Å; K86-L93 HydrophobicContact CB-CD1 4.47Å; K86-L93 HydrophobicContact CG-CD1 3.63Å; K86-D124 WeakPolarHBondContact CE-OD2 3.45Å; K86-D124 IonicContact NZ-OD1 3.99Å; K86-D124 PolarHBondContact NZ-OD1 3.19Å; K86-D124 IonicContact NZ-OD2 3.78Å; K86-D124 PolarHBondContact NZ-OD2 3.18Å
87	S	79.2	Confident	74	Confident	82 Å²	82	65.7 Å²	65.7	57%	0.573	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.3	175.9	63.9	0	0	0	0	114.7	P83 W84 L85	P83-S87 PolarHBondContact O-N 3.3Å; P83-S87 VanDerWaalsContact O-N 3.11Å; P83-S87 PolarHBondContact O-OG 3.24Å; W84-S87 PolarHBondContact O-N 3.48Å; W84-S87 PolarHBondContact O-OG 2.94Å; L85-S87 VanDerWaalsContact C-N 3.27Å; L85-S87 PolarHBondContact O-N 3.17Å
88	R	74.6	Confident	75	Confident	150 Å²	150	59.9 Å²	59.9	57%	0.566	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	12.1	-175.1	-70.9	-74.9	-179.7	178.6	-2.9	115.1	L64 W84 L85 K86	L64-R88 HydrophobicContact CD2-CB 4.02Å; W84-R88 HydrophobicContact CZ2-CG 4.44Å; W84-R88 WeakPolarHBondContact O-CG 3.21Å; L85-R88 PolarHBondContact O-N 3.38Å; K86-R88 VanDerWaalsContact C-N 3.28Å; K86-R88 PolarHBondContact O-N 3.45Å
89	S	56.2	Low	76.2	Confident	108 Å²	108	58 Å²	58	76%	0.755	34%	0.335	S	S	*	.			trans	54	52.8	172.7	-56.8	0	0	0	0	114.5
90	L	67.9	Low	77.3	Confident	25 Å²	25	56.2 Å²	56.2	13%	0.131	32%	0.32	C	S	.	.			trans	-81.3	136.4	161.3	-75.2	167.4	0	0	0	108.9	L64 S65 D92 L93	L64-L90 HydrophobicContact CD1-CD1 3.95Å; L64-L90 HydrophobicContact CD1-CD2 4.42Å; L64-L90 HydrophobicContact CD2-CD1 3.83Å; L64-L90 HydrophobicContact CD2-CG 4.3Å; L64-L90 HydrophobicContact CG-CD1 3.87Å; L64-L90 HydrophobicContact CG-CD2 4.12Å; L64-L90 HydrophobicContact CG-CG 4.14Å; S65-L90 VanDerWaalsContact C-CD2 3.46Å; S65-L90 WeakPolarHBondContact O-CD2 3.37Å; L90-D92 VanDerWaalsContact C-N 3.28Å; L90-D92 PolarHBondContact O-N 3.02Å; L90-L93 HydrophobicContact CB-CD2 4.34Å; L90-L93 HydrophobicContact CB-CG 4.33Å; L90-L93 HydrophobicContact CD1-CD2 3.52Å; L90-L93 HydrophobicContact CD1-CG 4.38Å
91	S	59.1	Low	78.2	Confident	100 Å²	100	56.1 Å²	56.1	70%	0.699	32%	0.316	S	S	*	.	S	Bend	trans	-64.6	-33.6	-175.2	-58.8	0	0	0	0	112.5	D66	D66-S91 VanDerWaalsContact CG-OG 3.3Å; D66-S91 PolarHBondContact OD1-N 2.82Å; D66-S91 PolarHBondContact OD1-OG 2.99Å; D66-S91 PolarHBondContact OD2-OG 2.92Å
92	D	66.6	Low	78.7	Confident	77 Å²	77	57.8 Å²	57.8	41%	0.412	33%	0.328	S	S	.	.			trans	-152.2	111.7	176.5	-168.7	-5.3	0	0	0	111	L90 S94 T95	L90-D92 VanDerWaalsContact C-N 3.28Å; L90-D92 PolarHBondContact O-N 3.02Å; D92-S94 VanDerWaalsContact C-N 3.29Å; D92-S94 VanDerWaalsContact OD1-CB 3.23Å; D92-S94 WeakPolarHBondContact OD1-CB 3.45Å; D92-S94 PolarHBondContact OD1-N 3.28Å; D92-S94 PolarHBondContact OD1-OG 3.32Å; D92-S94 PolarHBondContact OD2-OG 2.95Å; D92-S94 VanDerWaalsContact OD2-OG 3.1Å; D92-T95 PolarHBondContact O-OG1 3.42Å; D92-T95 VanDerWaalsContact O-OG1 3.09Å
93	L	69.1	Low	79.5	Confident	35 Å²	35	56.8 Å²	56.8	18%	0.183	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-79.5	-12.3	175.9	-81.5	167	0	0	0	112.7	L85 K86 L90 T95 V96	L85-L93 HydrophobicContact CB-CD2 4.36Å; K86-L93 HydrophobicContact CB-CD1 4.47Å; K86-L93 HydrophobicContact CG-CD1 3.63Å; L90-L93 HydrophobicContact CB-CD2 4.34Å; L90-L93 HydrophobicContact CB-CG 4.33Å; L90-L93 HydrophobicContact CD1-CD2 3.52Å; L90-L93 HydrophobicContact CD1-CG 4.38Å; L93-T95 VanDerWaalsContact C-N 3.27Å; L93-T95 PolarHBondContact O-N 2.65Å; L93-V96 PolarHBondContact O-N 2.92Å
94	S	65.4	Low	80.2	Confident	101 Å²	101	53.4 Å²	53.4	71%	0.706	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-75	-18.5	-178.6	75.7	0	0	0	0	113.1	D92	D92-S94 VanDerWaalsContact C-N 3.29Å; D92-S94 VanDerWaalsContact OD1-CB 3.23Å; D92-S94 WeakPolarHBondContact OD1-CB 3.45Å; D92-S94 PolarHBondContact OD1-N 3.28Å; D92-S94 PolarHBondContact OD1-OG 3.32Å; D92-S94 PolarHBondContact OD2-OG 2.95Å; D92-S94 VanDerWaalsContact OD2-OG 3.1Å
95	T	71.1	Confident	80.6	Confident	97 Å²	97	54.3 Å²	54.3	60%	0.595	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-93.2	-1.5	178.3	55.8	0	0	0	0	113.4	D92 L93	D92-T95 PolarHBondContact O-OG1 3.42Å; D92-T95 VanDerWaalsContact O-OG1 3.09Å; L93-T95 VanDerWaalsContact C-N 3.27Å; L93-T95 PolarHBondContact O-N 2.65Å
96	V	85.1	Confident	81.1	Confident	15 Å²	15	56.9 Å²	56.9	9%	0.091	33%	0.328	C	S	.	.	S	Bend	trans	-112	129.1	-175	-176	0	0	0	0	110.5	V68 V71 L93 V98	V68-V96 WeakPolarHBondContact O-CG2 3.35Å; V71-V96 HydrophobicContact CB-CG1 4.37Å; V71-V96 HydrophobicContact CG2-CG1 3.66Å; L93-V96 PolarHBondContact O-N 2.92Å; V96-V98 PolarHBondContact O-N 3.4Å
97	N	89.5	Confident	81.9	Confident	58 Å²	58	51.8 Å²	51.8	31%	0.31	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	112.6	173.9	-66.9	-48.7	0	0	0	109.9	T69 H70 V71 L99 V116	T69-N97 PolarHBondContact O-N 2.95Å; H70-N97 CarbonylContact C-O 3.58Å; H70-N97 WeakPolarHBondContact CA-O 3.41Å; H70-N97 PolarHBondContact NE2-ND2 3.46Å; V71-N97 PolarHBondContact N-O 3.36Å; N97-L99 HydrophobicContact CB-CD1 4.04Å; N97-L99 HydrophobicContact CB-CD2 4.15Å; N97-L99 HydrophobicContact CB-CG 4.02Å; N97-V116 HydrophobicContact CB-CG2 4.46Å
98	V	90.5	Very high	82.7	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	115.3	172.9	-173.6	0	0	0	0	109.5	V71 L81 W82 L85 V96 I122	V71-V98 HydrophobicContact CB-CG2 4.42Å; V71-V98 HydrophobicContact CG1-CG1 4.5Å; V71-V98 WeakPolarHBondContact O-CA 3.47Å; L81-V98 HydrophobicContact CD2-CG1 3.85Å; W82-V98 HydrophobicContact CH2-CB 3.83Å; W82-V98 HydrophobicContact CH2-CG1 4.47Å; W82-V98 HydrophobicContact CH2-CG2 3.4Å; W82-V98 VanDerWaalsContact CH2-CG2 3.4Å; W82-V98 HydrophobicContact CZ2-CB 3.69Å; W82-V98 HydrophobicContact CZ2-CG1 4.05Å; W82-V98 HydrophobicContact CZ2-CG2 3.8Å; W82-V98 HydrophobicContact CZ3-CG2 3.94Å; L85-V98 HydrophobicContact CD1-CG1 3.85Å; L85-V98 HydrophobicContact CD1-CG2 3.96Å; V96-V98 PolarHBondContact O-N 3.4Å; V98-I122 HydrophobicContact CG1-CB 4.26Å; V98-I122 PolarHBondContact O-N 3.43Å
99	L	91.8	Very high	83.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	147.3	-161.4	-57.4	175.1	0	0	0	112.9	H70 V71 V72 S73 N97 W103 V116 H120 L121 I122	H70-L99 HydrophobicContact CB-CD1 4.35Å; H70-L99 VanDerWaalsContact CD2-CD1 3.5Å; H70-L99 WeakPolarHBondContact CD2-CD1 3.33Å; V71-L99 PolarHBondContact O-N 2.67Å; V72-L99 WeakPolarHBondContact CA-O 3.3Å; V72-L99 HydrophobicContact CG2-CB 4.41Å; S73-L99 PolarHBondContact N-O 3.2Å; N97-L99 HydrophobicContact CB-CD1 4.04Å; N97-L99 HydrophobicContact CB-CD2 4.15Å; N97-L99 HydrophobicContact CB-CG 4.02Å; L99-W103 HydrophobicContact CB-CB 4.34Å; L99-W103 HydrophobicContact CD1-CB 4.21Å; L99-W103 HydrophobicContact CD1-CD2 3.55Å; L99-W103 HydrophobicContact CD1-CE3 3.81Å; L99-W103 HydrophobicContact CD1-CG 3.72Å; L99-W103 HydrophobicContact CD1-CZ3 4.45Å; L99-V116 HydrophobicContact CD1-CG2 4.08Å; L99-V116 HydrophobicContact CD2-CG1 3.6Å; L99-V116 HydrophobicContact CD2-CG2 4.27Å; L99-H120 CarbonylContact C-O 3.5Å; L99-H120 WeakPolarHBondContact CA-O 3.32Å; L99-H120 HydrophobicContact CD2-CB 4.06Å; L99-H120 WeakPolarHBondContact CD2-O 3.28Å; L99-L121 HydrophobicContact CD2-CD2 3.74Å; L99-L121 HydrophobicContact CD2-CG 4.33Å; L99-I122 VanDerWaalsContact C-CD1 3.49Å; L99-I122 VanDerWaalsContact O-CD1 3.31Å; L99-I122 WeakPolarHBondContact O-CD1 3.19Å
100	D	92.3	Very high	85.2	Confident	36 Å²	36	49.3 Å²	49.3	19%	0.193	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	154.6	167.5	178.4	-95.7	0	0	0	110.8	S73 S102 W103 H120 I122	S73-D100 CarbonylContact O-C 3.6Å; D100-S102 PolarHBondContact O-N 3.12Å; D100-S102 WeakPolarHBondContact OD1-CB 3.35Å; D100-S102 PolarHBondContact OD1-N 2.89Å; D100-S102 PolarHBondContact OD1-OG 2.96Å; D100-W103 PolarHBondContact O-N 3.23Å; D100-W103 VanDerWaalsContact O-N 3.15Å; D100-H120 PolarHBondContact N-O 3.48Å; D100-I122 HydrophobicContact CB-CD1 4.46Å; D100-I122 HydrophobicContact CB-CG1 4.13Å
101	I	93.9	Very high	86.4	Confident	30 Å²	30	49.4 Å²	49.4	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-57.6	-21.6	-179.8	-164.7	63.6	0	0	0	113.8	M41 L49 V72 S73 E74 W103 F104 T105	M41-I101 HydrophobicContact CE-CD1 4.24Å; L49-I101 HydrophobicContact CD1-CD1 4.03Å; V72-I101 HydrophobicContact CG1-CD1 3.87Å; S73-I101 PolarHBondContact O-N 3.48Å; E74-I101 HydrophobicContact CG-CB 3.73Å; E74-I101 HydrophobicContact CG-CD1 3.92Å; E74-I101 HydrophobicContact CG-CG1 3.66Å; E74-I101 HydrophobicContact CG-CG2 4.1Å; I101-W103 VanDerWaalsContact C-N 3.31Å; I101-W103 PolarHBondContact O-N 2.92Å; I101-F104 HydrophobicContact CD1-CB 4.17Å; I101-F104 HydrophobicContact CD1-CD1 4.44Å; I101-F104 HydrophobicContact CD1-CG 4.43Å; I101-F104 PolarHBondContact O-N 2.59Å; I101-T105 PolarHBondContact O-N 3.4Å; I101-T105 PolarHBondContact O-OG1 2.83Å
102	S	92.9	Very high	88	Confident	35 Å²	35	51 Å²	51	25%	0.245	27%	0.274	C	S	.	.	H	α-helix	trans	-53.9	-43.4	173.3	50.3	0	0	0	0	112.8	D100 F104 T105 D106	D100-S102 PolarHBondContact O-N 3.12Å; D100-S102 WeakPolarHBondContact OD1-CB 3.35Å; D100-S102 PolarHBondContact OD1-N 2.89Å; D100-S102 PolarHBondContact OD1-OG 2.96Å; S102-F104 VanDerWaalsContact C-N 3.34Å; S102-F104 PolarHBondContact O-N 2.95Å; S102-T105 WeakPolarHBondContact O-CB 3.17Å; S102-T105 PolarHBondContact O-N 3.41Å; S102-T105 VanDerWaalsContact O-N 3.17Å; S102-D106 PolarHBondContact O-N 3.06Å
103	W	95.7	Very high	89.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-41.1	178.1	177.3	84.3	0	0	0	112.8	V32 I34 H70 V72 L99 D100 I101 T105 D106 S107 P113 V114 H120	V32-W103 HydrophobicContact CG1-CH2 3.86Å; V32-W103 HydrophobicContact CG1-CZ2 4.37Å; I34-W103 HydrophobicContact CD1-CH2 4.01Å; I34-W103 HydrophobicContact CD1-CZ3 3.82Å; I34-W103 HydrophobicContact CG1-CH2 4.26Å; I34-W103 HydrophobicContact CG1-CZ3 4.15Å; H70-W103 HydrophobicContact CB-CH2 4.38Å; H70-W103 HydrophobicContact CB-CZ3 4.42Å; H70-W103 AromaticContact CD2-CE2 3.99Å; H70-W103 AromaticContact CD2-CH2 3.59Å; H70-W103 AromaticContact CD2-CZ2 3.49Å; H70-W103 VanDerWaalsContact CD2-CZ2 3.49Å; H70-W103 WeakPolarHBondContact CD2-CZ2 3.49Å; H70-W103 AromaticContact NE2-CZ2 3.86Å; V72-W103 HydrophobicContact CG2-CE3 3.86Å; V72-W103 HydrophobicContact CG2-CZ3 4.03Å; L99-W103 HydrophobicContact CB-CB 4.34Å; L99-W103 HydrophobicContact CD1-CB 4.21Å; L99-W103 HydrophobicContact CD1-CD2 3.55Å; L99-W103 HydrophobicContact CD1-CE3 3.81Å; L99-W103 HydrophobicContact CD1-CG 3.72Å; L99-W103 HydrophobicContact CD1-CZ3 4.45Å; D100-W103 PolarHBondContact O-N 3.23Å; D100-W103 VanDerWaalsContact O-N 3.15Å; I101-W103 VanDerWaalsContact C-N 3.31Å; I101-W103 PolarHBondContact O-N 2.92Å; W103-T105 VanDerWaalsContact C-N 3.33Å; W103-D106 PolarHBondContact O-N 2.9Å; W103-S107 WeakPolarHBondContact O-CB 3.28Å; W103-S107 PolarHBondContact O-N 3.5Å; W103-S107 PolarHBondContact O-OG 3.19Å; W103-P113 HydrophobicContact CZ2-CB 4.23Å; W103-V114 PolarHBondContact NE1-O 2.9Å; W103-H120 HydrophobicContact CB-CB 3.89Å; W103-H120 AromaticContact CD1-CG 3.95Å; W103-H120 AromaticContact CD1-ND1 3.62Å; W103-H120 HydrophobicContact CG-CB 4.46Å
104	F	95.6	Very high	90.5	Very high	4 Å²	4	48 Å²	48	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-65.2	-42.3	177	-178.7	-81.1	0	0	0	110.4	I34 L36 L49 A53 V72 I101 S102 S107 M108	I34-F104 HydrophobicContact CD1-CD2 4.38Å; I34-F104 HydrophobicContact CD1-CE2 4.45Å; L36-F104 HydrophobicContact CD1-CE2 4.49Å; L36-F104 HydrophobicContact CD2-CD2 3.93Å; L36-F104 HydrophobicContact CD2-CE2 3.98Å; L49-F104 HydrophobicContact CB-CE1 4.17Å; L49-F104 HydrophobicContact CB-CZ 3.97Å; L49-F104 HydrophobicContact CD2-CD1 4.3Å; L49-F104 HydrophobicContact CD2-CE1 3.63Å; L49-F104 HydrophobicContact CD2-CZ 4.28Å; L49-F104 HydrophobicContact CG-CE1 4.35Å; L49-F104 WeakPolarHBondContact O-CZ 3.37Å; A53-F104 HydrophobicContact CB-CE2 3.77Å; A53-F104 HydrophobicContact CB-CZ 3.78Å; V72-F104 HydrophobicContact CG1-CB 3.88Å; V72-F104 HydrophobicContact CG2-CB 4.47Å; I101-F104 HydrophobicContact CD1-CB 4.17Å; I101-F104 HydrophobicContact CD1-CD1 4.44Å; I101-F104 HydrophobicContact CD1-CG 4.43Å; I101-F104 PolarHBondContact O-N 2.59Å; S102-F104 VanDerWaalsContact C-N 3.34Å; S102-F104 PolarHBondContact O-N 2.95Å; F104-S107 PolarHBondContact O-N 2.84Å; F104-M108 HydrophobicContact CD1-CG 3.74Å; F104-M108 HydrophobicContact CD2-CE 4.16Å; F104-M108 HydrophobicContact CE1-CE 4.24Å; F104-M108 HydrophobicContact CE1-CG 3.31Å; F104-M108 HydrophobicContact CE1-SD 4.05Å; F104-M108 HydrophobicContact CE2-CE 3.8Å; F104-M108 HydrophobicContact CE2-SD 4.45Å; F104-M108 HydrophobicContact CG-CG 4.49Å; F104-M108 HydrophobicContact CZ-CE 3.84Å; F104-M108 HydrophobicContact CZ-CG 3.79Å; F104-M108 HydrophobicContact CZ-SD 3.88Å; F104-M108 VanDerWaalsContact O-CG 3.27Å; F104-M108 WeakPolarHBondContact O-CG 3.41Å; F104-M108 PolarHBondContact O-N 3.05Å
105	T	94.2	Very high	91.7	Very high	75 Å²	75	47.5 Å²	47.5	46%	0.46	26%	0.255	S	S	.	.	H	α-helix	trans	-60.7	-47.1	178.3	-56.6	0	0	0	0	111.3	I101 S102 W103 M108 K109	I101-T105 PolarHBondContact O-N 3.4Å; I101-T105 PolarHBondContact O-OG1 2.83Å; S102-T105 WeakPolarHBondContact O-CB 3.17Å; S102-T105 PolarHBondContact O-N 3.41Å; S102-T105 VanDerWaalsContact O-N 3.17Å; W103-T105 VanDerWaalsContact C-N 3.33Å; T105-M108 PolarHBondContact O-N 2.87Å; T105-K109 WeakPolarHBondContact O-CB 3.26Å; T105-K109 PolarHBondContact O-N 3.08Å
106	D	93.7	Very high	92.7	Very high	54 Å²	54	45.2 Å²	45.2	29%	0.289	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-42.3	177.8	-72.5	-9.2	0	0	0	111.3	S102 W103 M108 K109 E110 V114 H120	S102-D106 PolarHBondContact O-N 3.06Å; W103-D106 PolarHBondContact O-N 2.9Å; D106-M108 PolarHBondContact O-N 3.01Å; D106-K109 WeakPolarHBondContact O-CB 3.31Å; D106-K109 PolarHBondContact O-N 3.34Å; D106-E110 WeakPolarHBondContact O-CG 3.35Å; D106-E110 PolarHBondContact O-N 3.11Å; D106-V114 HydrophobicContact CB-CG2 4.08Å; D106-H120 IonicContact OD2-NE2 2.89Å; D106-H120 PolarHBondContact OD2-NE2 3.22Å
107	S	95	Very high	92.7	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-39.4	176.5	-61.7	0	0	0	0	113.2	W103 F104 K109 G111 R112 V114	W103-S107 WeakPolarHBondContact O-CB 3.28Å; W103-S107 PolarHBondContact O-N 3.5Å; W103-S107 PolarHBondContact O-OG 3.19Å; F104-S107 PolarHBondContact O-N 2.84Å; S107-K109 VanDerWaalsContact C-N 3.35Å; S107-G111 PolarHBondContact O-N 3.15Å; S107-R112 WeakPolarHBondContact CA-O 3.46Å; S107-R112 PolarHBondContact O-N 3.21Å; S107-V114 PolarHBondContact OG-N 3.12Å
108	M	96.1	Very high	92.3	Very high	13 Å²	13	51.7 Å²	51.7	6%	0.064	28%	0.277	C	S	.	.	H	α-helix	trans	-69	-35.7	176.4	-68.2	-50.5	112.7	0	0	112	L52 A53 K56 F58 F104 T105 D106 G111	L52-M108 HydrophobicContact CD2-CB 4.49Å; L52-M108 HydrophobicContact CD2-CG 4.08Å; L52-M108 HydrophobicContact CG-CG 4.32Å; L52-M108 HydrophobicContact CG-SD 4.16Å; A53-M108 HydrophobicContact CB-CE 3.89Å; A53-M108 HydrophobicContact CB-SD 4.04Å; K56-M108 HydrophobicContact CD-CB 4.46Å; K56-M108 HydrophobicContact CD-SD 3.8Å; K56-M108 VanDerWaalsContact CE-O 3.26Å; K56-M108 WeakPolarHBondContact CE-O 3.37Å; K56-M108 PolarHBondContact NZ-O 3.11Å; F58-M108 HydrophobicContact CD1-CE 4.15Å; F58-M108 HydrophobicContact CD2-CE 3.72Å; F58-M108 HydrophobicContact CD2-SD 4.48Å; F58-M108 HydrophobicContact CE1-CE 3.93Å; F58-M108 HydrophobicContact CE2-CE 3.52Å; F58-M108 HydrophobicContact CE2-SD 4.3Å; F58-M108 HydrophobicContact CG-CE 4.02Å; F58-M108 HydrophobicContact CZ-CE 3.61Å; F104-M108 HydrophobicContact CD1-CG 3.74Å; F104-M108 HydrophobicContact CD2-CE 4.16Å; F104-M108 HydrophobicContact CE1-CE 4.24Å; F104-M108 HydrophobicContact CE1-CG 3.31Å; F104-M108 HydrophobicContact CE1-SD 4.05Å; F104-M108 HydrophobicContact CE2-CE 3.8Å; F104-M108 HydrophobicContact CE2-SD 4.45Å; F104-M108 HydrophobicContact CG-CG 4.49Å; F104-M108 HydrophobicContact CZ-CE 3.84Å; F104-M108 HydrophobicContact CZ-CG 3.79Å; F104-M108 HydrophobicContact CZ-SD 3.88Å; F104-M108 VanDerWaalsContact O-CG 3.27Å; F104-M108 WeakPolarHBondContact O-CG 3.41Å; F104-M108 PolarHBondContact O-N 3.05Å; T105-M108 PolarHBondContact O-N 2.87Å; D106-M108 PolarHBondContact O-N 3.01Å; M108-G111 PolarHBondContact O-N 3.32Å
109	K	93.1	Very high	91.9	Very high	167 Å²	167	57.6 Å²	57.6	73%	0.726	30%	0.302	S	S	*	.	H	α-helix	trans	-64.1	-45.8	176.7	-173.6	-177.3	177.3	-172.1	0	111.3	T105 D106 S107 G111	T105-K109 WeakPolarHBondContact O-CB 3.26Å; T105-K109 PolarHBondContact O-N 3.08Å; D106-K109 WeakPolarHBondContact O-CB 3.31Å; D106-K109 PolarHBondContact O-N 3.34Å; S107-K109 VanDerWaalsContact C-N 3.35Å; K109-G111 VanDerWaalsContact C-N 3.31Å
110	E	90.9	Very high	91.7	Very high	108 Å²	108	57.7 Å²	57.7	51%	0.505	30%	0.302	S	S	.	.	H	α-helix	trans	-79.5	-12.7	178.9	-64.8	-59.4	128.8	0	0	113.5	D106 R112 V114	D106-E110 WeakPolarHBondContact O-CG 3.35Å; D106-E110 PolarHBondContact O-N 3.11Å; E110-R112 HydrophobicContact CB-CG 4.27Å; E110-R112 PolarHBondContact O-N 3.29Å; E110-V114 HydrophobicContact CB-CG1 4.11Å; E110-V114 HydrophobicContact CG-CG1 3.9Å
111	G	91.9	Very high	91.5	Very high	27 Å²	27	59.6 Å²	59.6	28%	0.278	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	13.4	-178.9	0	0	0	0	0	114.4	S107 M108 K109	S107-G111 PolarHBondContact O-N 3.15Å; M108-G111 PolarHBondContact O-N 3.32Å; K109-G111 VanDerWaalsContact C-N 3.31Å
112	R	93.1	Very high	91	Very high	133 Å²	133	58.7 Å²	58.7	50%	0.502	31%	0.307	S	S	.	.	S	Bend	trans	-152.1	157.5	178.9	65.1	-177.7	-180	98.6	-0.4	110.4	F29 F58 S107 E110 V114	F29-R112 HydrophobicContact CE1-CB 4.05Å; F29-R112 HydrophobicContact CE2-CB 4.44Å; F29-R112 HydrophobicContact CZ-CB 3.69Å; F58-R112 VanDerWaalsContact CZ-C 3.41Å; S107-R112 WeakPolarHBondContact CA-O 3.46Å; S107-R112 PolarHBondContact O-N 3.21Å; E110-R112 HydrophobicContact CB-CG 4.27Å; E110-R112 PolarHBondContact O-N 3.29Å; R112-V114 PolarHBondContact O-N 2.91Å
113	P	94.1	Very high	90.1	Very high	28 Å²	28	64 Å²	64	18%	0.182	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-58.6	122.5	173.8	-19.1	28.6	0	0	0	110.8	F29 V32 F58 W103	F29-P113 HydrophobicContact CB-CG 4.03Å; F29-P113 HydrophobicContact CD1-CG 4.03Å; F29-P113 HydrophobicContact CD2-CG 4.33Å; F29-P113 HydrophobicContact CG-CG 3.87Å; V32-P113 HydrophobicContact CB-CB 4.44Å; V32-P113 HydrophobicContact CB-CG 4.02Å; V32-P113 HydrophobicContact CG1-CB 4.28Å; V32-P113 HydrophobicContact CG1-CG 4.18Å; V32-P113 HydrophobicContact CG2-CB 3.93Å; V32-P113 HydrophobicContact CG2-CG 3.82Å; F58-P113 HydrophobicContact CD1-CG 4.15Å; F58-P113 HydrophobicContact CE1-CB 4.11Å; F58-P113 HydrophobicContact CE1-CG 3.56Å; F58-P113 HydrophobicContact CZ-CG 4.21Å; W103-P113 HydrophobicContact CZ2-CB 4.23Å
114	V	93.7	Very high	88.8	Confident	23 Å²	23	66.9 Å²	66.9	14%	0.139	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-83.5	154.1	172.2	-60.1	0	0	0	0	110.4	W103 D106 S107 E110 R112 V116	W103-V114 PolarHBondContact NE1-O 2.9Å; D106-V114 HydrophobicContact CB-CG2 4.08Å; S107-V114 PolarHBondContact OG-N 3.12Å; E110-V114 HydrophobicContact CB-CG1 4.11Å; E110-V114 HydrophobicContact CG-CG1 3.9Å; R112-V114 PolarHBondContact O-N 2.91Å; V114-V116 PolarHBondContact O-N 2.93Å
115	P	92.4	Very high	87	Confident	89 Å²	89	70.7 Å²	70.7	58%	0.578	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-54.5	139.5	172.7	-25.2	35	0	0	0	112	E117	P115-E117 PolarHBondContact O-N 3.16Å
116	V	90.4	Very high	84.6	Confident	49 Å²	49	74.1 Å²	74.1	30%	0.297	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-71.8	126.2	173.5	177.2	0	0	0	0	108.5	N97 L99 V114 L121	N97-V116 HydrophobicContact CB-CG2 4.46Å; L99-V116 HydrophobicContact CD1-CG2 4.08Å; L99-V116 HydrophobicContact CD2-CG1 3.6Å; L99-V116 HydrophobicContact CD2-CG2 4.27Å; V114-V116 PolarHBondContact O-N 2.93Å; V116-L121 HydrophobicContact CG1-CD2 3.82Å; V116-L121 HydrophobicContact CG1-CG 3.99Å
117	E	86.3	Confident	82.1	Confident	95 Å²	95	77 Å²	77	44%	0.444	40%	0.399	S	S	.	.			trans	-119	161.6	-179.8	-69.3	178.4	-157.3	0	0	108.8	P115 K119 H120	P115-E117 PolarHBondContact O-N 3.16Å; E117-K119 HydrophobicContact CB-CG 4.19Å; E117-K119 PolarHBondContact O-N 2.81Å; E117-K119 VanDerWaalsContact O-N 3.08Å; E117-K119 IonicContact OE1-NZ 2.8Å; E117-K119 WeakPolarHBondContact OE2-CD 3.45Å; E117-K119 WeakPolarHBondContact OE2-CE 3.46Å; E117-K119 IonicContact OE2-NZ 3.53Å; E117-K119 PolarHBondContact OE2-NZ 2.85Å; E117-H120 PolarHBondContact N-ND1 3.48Å; E117-H120 VanDerWaalsContact O-CB 3.29Å; E117-H120 WeakPolarHBondContact O-CB 3.18Å; E117-H120 PolarHBondContact O-N 2.92Å
118	T	80.4	Confident	79.4	Confident	115 Å²	115	85.3 Å²	85.3	71%	0.706	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-55.7	-32.3	-179.6	-44	0	0	0	0	113.2	H120 L121	T118-H120 PolarHBondContact O-N 3.32Å; T118-L121 PolarHBondContact O-N 3.06Å
119	K	81.9	Confident	76.6	Confident	129 Å²	129	88.5 Å²	88.5	56%	0.561	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-66.7	-21.7	177.4	75.9	-168.7	-173.9	-152	0	113.5	E117	E117-K119 HydrophobicContact CB-CG 4.19Å; E117-K119 PolarHBondContact O-N 2.81Å; E117-K119 VanDerWaalsContact O-N 3.08Å; E117-K119 IonicContact OE1-NZ 2.8Å; E117-K119 WeakPolarHBondContact OE2-CD 3.45Å; E117-K119 WeakPolarHBondContact OE2-CE 3.46Å; E117-K119 IonicContact OE2-NZ 3.53Å; E117-K119 PolarHBondContact OE2-NZ 2.85Å
120	H	89.1	Confident	74	Confident	2 Å²	2	86.3 Å²	86.3	1%	0.009	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-88.6	-19.3	-179	-61.3	144.5	0	0	0	112.9	L99 D100 W103 D106 E117 T118	L99-H120 CarbonylContact C-O 3.5Å; L99-H120 WeakPolarHBondContact CA-O 3.32Å; L99-H120 HydrophobicContact CD2-CB 4.06Å; L99-H120 WeakPolarHBondContact CD2-O 3.28Å; D100-H120 PolarHBondContact N-O 3.48Å; W103-H120 HydrophobicContact CB-CB 3.89Å; W103-H120 AromaticContact CD1-CG 3.95Å; W103-H120 AromaticContact CD1-ND1 3.62Å; W103-H120 HydrophobicContact CG-CB 4.46Å; D106-H120 IonicContact OD2-NE2 2.89Å; D106-H120 PolarHBondContact OD2-NE2 3.22Å; E117-H120 PolarHBondContact N-ND1 3.48Å; E117-H120 VanDerWaalsContact O-CB 3.29Å; E117-H120 WeakPolarHBondContact O-CB 3.18Å; E117-H120 PolarHBondContact O-N 2.92Å; T118-H120 PolarHBondContact O-N 3.32Å
121	L	86.6	Confident	71.5	Confident	75 Å²	75	90.7 Å²	90.7	39%	0.393	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-83.8	131.3	-170.8	-71.9	166.7	0	0	0	112	L99 V116 T118	L99-L121 HydrophobicContact CD2-CD2 3.74Å; L99-L121 HydrophobicContact CD2-CG 4.33Å; V116-L121 HydrophobicContact CG1-CD2 3.82Å; V116-L121 HydrophobicContact CG1-CG 3.99Å; T118-L121 PolarHBondContact O-N 3.06Å
122	I	84.3	Confident	68.9	Low	11 Å²	11	92.6 Å²	92.6	6%	0.056	50%	0.5	C	S	.	.			trans	-89.3	108.1	166.5	-57.9	171.3	0	0	0	107.2	L81 W82 V98 L99 D100	L81-I122 HydrophobicContact CD2-CB 4.47Å; L81-I122 HydrophobicContact CD2-CD1 3.65Å; L81-I122 HydrophobicContact CD2-CG2 4.03Å; W82-I122 WeakPolarHBondContact CZ2-O 3.28Å; W82-I122 PolarHBondContact NE1-O 3.24Å; V98-I122 HydrophobicContact CG1-CB 4.26Å; V98-I122 PolarHBondContact O-N 3.43Å; L99-I122 VanDerWaalsContact C-CD1 3.49Å; L99-I122 VanDerWaalsContact O-CD1 3.31Å; L99-I122 WeakPolarHBondContact O-CD1 3.19Å; D100-I122 HydrophobicContact CB-CD1 4.46Å; D100-I122 HydrophobicContact CB-CG1 4.13Å
123	Q	74.3	Confident	66.2	Low	148 Å²	148	90.3 Å²	90.3	69%	0.692	51%	0.509	S	S	*	.			trans	-65.4	133.6	-174.8	-63.9	179.8	-6.9	0	0	112.1	S78 W82	S78-Q123 WeakPolarHBondContact CB-O 3.15Å; W82-Q123 VanDerWaalsContact NE1-C 3.26Å; W82-Q123 PolarHBondContact NE1-O 2.74Å
124	D	68	Low	63.6	Low	60 Å²	60	94.5 Å²	94.5	32%	0.321	54%	0.537	S	S	.	.			trans	-62.7	138.5	167.4	-165.4	6.5	0	0	0	108.6	W82 K86 L126	W82-D124 WeakPolarHBondContact CB-OD1 3.35Å; W82-D124 HydrophobicContact CD2-CB 3.66Å; W82-D124 HydrophobicContact CE3-CB 3.93Å; W82-D124 HydrophobicContact CG-CB 4.2Å; W82-D124 VanDerWaalsContact CG-OD1 3.25Å; W82-D124 HydrophobicContact CH2-CB 3.94Å; W82-D124 HydrophobicContact CZ2-CB 3.7Å; W82-D124 HydrophobicContact CZ3-CB 4.06Å; W82-D124 VanDerWaalsContact NE1-CA 3.26Å; K86-D124 WeakPolarHBondContact CE-OD2 3.45Å; K86-D124 IonicContact NZ-OD1 3.99Å; K86-D124 PolarHBondContact NZ-OD1 3.19Å; K86-D124 IonicContact NZ-OD2 3.78Å; K86-D124 PolarHBondContact NZ-OD2 3.18Å; D124-L126 VanDerWaalsContact C-N 3.34Å; D124-L126 PolarHBondContact O-N 2.81Å
125	I	57.3	Low	61.6	Low	83 Å²	83	98.7 Å²	98.7	43%	0.426	56%	0.562	S	S	.	*			trans	-62.3	108.5	168	-64	-174.7	0	0	0	104.8
126	L	44.3	Very low	59.9	Low	148 Å²	148	101.5 Å²	101.5	78%	0.775	57%	0.572	S	S	*	*			trans	-40.4	132.9	167.9	-74.5	163.6	0	0	0	107.8	D124 E128	D124-L126 VanDerWaalsContact C-N 3.34Å; D124-L126 PolarHBondContact O-N 2.81Å; L126-E128 PolarHBondContact O-N 2.87Å; L126-E128 VanDerWaalsContact O-N 3.15Å
127	P	41.3	Very low	59.7	Low	113 Å²	113	107.7 Å²	107.7	73%	0.734	60%	0.595	S	S	*	*			trans	-49.6	132	172.1	20.7	-29.7	0	0	0	107.6	A129	P127-A129 PolarHBondContact O-N 3.41Å
128	E	37.4	Very low	60	Low	176 Å²	176	104.9 Å²	104.9	82%	0.822	58%	0.584	S	S	*	*			trans	-41.4	121.7	172.4	-84.4	-175.8	152.8	0	0	107.1	L126	L126-E128 PolarHBondContact O-N 2.87Å; L126-E128 VanDerWaalsContact O-N 3.15Å
129	A	37.8	Very low	60.8	Low	79 Å²	79	100.5 Å²	100.5	65%	0.653	56%	0.558	S	S	*	*			trans	-44.2	135.7	172.4	0	0	0	0	0	107.3	P127 K131	P127-A129 PolarHBondContact O-N 3.41Å; A129-K131 PolarHBondContact O-N 2.71Å
130	P	38.4	Very low	61.5	Low	121 Å²	121	98.2 Å²	98.2	79%	0.786	55%	0.55	S	S	*	.			trans	-46.5	122.1	180	20.2	-31.7	0	0	0	106.6	A132	P130-A132 VanDerWaalsContact C-N 3.3Å; P130-A132 WeakPolarHBondContact O-CA 3.42Å; P130-A132 PolarHBondContact O-N 3.02Å
131	K	37.9	Very low	61.9	Low	201 Å²	201	98.5 Å²	98.5	87%	0.874	55%	0.551	S	S	*	*			trans	-36.6	102.7	-175.2	-93	-176.8	178.5	175.2	0	107.2	A129 A133	A129-K131 PolarHBondContact O-N 2.71Å; K131-A133 PolarHBondContact O-N 3.05Å
132	A	37.6	Very low	62.5	Low	66 Å²	66	95 Å²	95	55%	0.545	53%	0.533	S	S	.	.			trans	-58.4	125.7	-173.7	0	0	0	0	0	104.4	P130 V135	P130-A132 VanDerWaalsContact C-N 3.3Å; P130-A132 WeakPolarHBondContact O-CA 3.42Å; P130-A132 PolarHBondContact O-N 3.02Å; A132-V135 HydrophobicContact CB-CG2 3.66Å
133	A	36.6	Very low	63.1	Low	85 Å²	85	96 Å²	96	70%	0.702	54%	0.54	S	S	*	.	S	Bend	trans	-38.9	130.3	161.7	0	0	0	0	0	106.4	K131 V135	K131-A133 PolarHBondContact O-N 3.05Å; A133-V135 PolarHBondContact O-N 2.74Å
134	P	40.5	Very low	64.2	Low	117 Å²	117	94 Å²	94	76%	0.76	53%	0.531	S	S	*	.			trans	-44.2	105.8	-160.6	16.6	-30.8	0	0	0	108.3	N136	P134-N136 VanDerWaalsContact C-N 3.3Å; P134-N136 PolarHBondContact O-N 2.89Å
135	V	50.5	Low	65.6	Low	111 Å²	111	92.2 Å²	92.2	67%	0.673	52%	0.52	S	S	*	.			trans	-60.8	108.7	178.8	177.6	0	0	0	0	102.2	A132 A133 K137	A132-V135 HydrophobicContact CB-CG2 3.66Å; A133-V135 PolarHBondContact O-N 2.74Å; V135-K137 VanDerWaalsContact C-N 3.34Å; V135-K137 PolarHBondContact O-N 2.88Å
136	N	58.3	Low	67.5	Low	147 Å²	147	99.4 Å²	99.4	79%	0.786	54%	0.542	S	S	*	.			trans	-50.5	109.1	179.4	-86.9	-33.9	0	0	0	105.8	P134 V138	P134-N136 VanDerWaalsContact C-N 3.3Å; P134-N136 PolarHBondContact O-N 2.89Å; N136-V138 PolarHBondContact O-N 3.5Å
137	K	85.3	Confident	70	Confident	180 Å²	180	95.4 Å²	95.4	78%	0.783	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-51.6	119.1	-173.9	-177.9	176.2	-178.1	174.1	0	106.7	V135 S139	V135-K137 VanDerWaalsContact C-N 3.34Å; V135-K137 PolarHBondContact O-N 2.88Å; K137-S139 PolarHBondContact O-N 2.88Å
138	V	93.3	Very high	72.6	Confident	36 Å²	36	94.7 Å²	94.7	22%	0.218	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-56.1	117.1	-176	176.7	0	0	0	0	107.4	N136 R145 V185 L189 L202 P203	N136-V138 PolarHBondContact O-N 3.5Å; V138-R145 HydrophobicContact CG1-CG 4.48Å; V138-V185 HydrophobicContact CG1-CG1 4.15Å; V138-L189 HydrophobicContact CG2-CD2 4.37Å; V138-L202 HydrophobicContact CB-CD2 3.94Å; V138-L202 HydrophobicContact CG1-CD2 4.36Å; V138-L202 HydrophobicContact CG2-CD2 3.7Å; V138-P203 HydrophobicContact CG1-CG 4.42Å; V138-P203 WeakPolarHBondContact O-CD 3.5Å; V138-P203 VanDerWaalsContact O-CG 3.29Å; V138-P203 WeakPolarHBondContact O-CG 3.45Å
139	S	96.5	Very high	75.3	Confident	22 Å²	22	90.8 Å²	90.8	15%	0.154	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-68.2	146.4	-176.1	177.4	0	0	0	0	110.5	K137 Y141 Q144 R145	K137-S139 PolarHBondContact O-N 2.88Å; S139-Y141 PolarHBondContact O-N 3.11Å; S139-Y141 PolarHBondContact OG-N 2.99Å; S139-Y141 VanDerWaalsContact OG-N 3.07Å; S139-Q144 PolarHBondContact OG-OE1 2.88Å; S139-R145 WeakPolarHBondContact O-CD 3.41Å; S139-R145 PolarHBondContact O-NH1 3.04Å
140	Q	96.9	Very high	78.1	Confident	81 Å²	81	93.4 Å²	93.4	38%	0.379	50%	0.499	S	S	.	.	S	Bend	trans	-66.3	-20.1	169.6	62.1	168.2	-52.7	0	0	112.7	R145 P203 R449	Q140-R145 PolarHBondContact O-NH1 2.79Å; Q140-R145 VanDerWaalsContact O-NH1 3.08Å; Q140-P203 HydrophobicContact CB-CB 3.88Å; Q140-P203 HydrophobicContact CB-CG 4.29Å; Q140-R449 PolarHBondContact O-NH2 3.2Å
141	Y	98	Very high	80.8	Confident	8 Å²	8	88.9 Å²	88.9	3%	0.031	47%	0.469	C	S	.	.	S	Bend	trans	-93.6	120.9	-177.8	-62.9	-79	0	0	0	111.3	S139 C143 Q144 R145 D446 R449 F450 E454	S139-Y141 PolarHBondContact O-N 3.11Å; S139-Y141 PolarHBondContact OG-N 2.99Å; S139-Y141 VanDerWaalsContact OG-N 3.07Å; Y141-C143 PolarHBondContact O-N 2.85Å; Y141-Q144 PolarHBondContact O-N 3.16Å; Y141-R145 PolarHBondContact O-NH1 2.99Å; Y141-D446 HydrophobicContact CD1-CB 4.45Å; Y141-R449 VanDerWaalsContact CD1-CZ 3.48Å; Y141-R449 VanDerWaalsContact CD1-NH2 3.3Å; Y141-R449 HydrophobicContact CE1-CB 4.31Å; Y141-R449 HydrophobicContact CE1-CG 3.96Å; Y141-F450 HydrophobicContact CD1-CB 3.72Å; Y141-F450 HydrophobicContact CD1-CD2 4.21Å; Y141-F450 HydrophobicContact CD1-CG 4.48Å; Y141-F450 AromaticContact CD2-CD2 3.71Å; Y141-F450 HydrophobicContact CD2-CD2 3.71Å; Y141-F450 HydrophobicContact CD2-CE2 4.43Å; Y141-F450 HydrophobicContact CE1-CB 4.03Å; Y141-F450 HydrophobicContact CE1-CD2 4.41Å; Y141-F450 AromaticContact CE2-CD2 3.96Å; Y141-F450 HydrophobicContact CE2-CD2 3.96Å; Y141-F450 HydrophobicContact CG-CB 4.11Å; Y141-F450 AromaticContact CG-CD2 3.86Å; Y141-F450 HydrophobicContact CG-CD2 3.86Å; Y141-F450 HydrophobicContact CG-CG 4.44Å; Y141-E454 HydrophobicContact CE2-CG 3.78Å; Y141-E454 WeakPolarHBondContact CE2-OE1 3.48Å; Y141-E454 VanDerWaalsContact CZ-OE1 3.3Å; Y141-E454 PolarHBondContact OH-OE1 3.33Å
142	A	98.1	Very high	83.7	Confident	3 Å²	3	82.1 Å²	82.1	3%	0.025	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-57.1	-31.6	177.7	0	0	0	0	0	113.2	Q144 R145 D446	A142-Q144 PolarHBondContact O-N 2.88Å; A142-R145 VanDerWaalsContact CA-CZ 3.43Å; A142-R145 VanDerWaalsContact CA-NH2 3.33Å; A142-R145 PolarHBondContact O-N 2.96Å; A142-D446 HydrophobicContact CB-CB 3.91Å; A142-D446 PolarHBondContact N-OD2 3.46Å
143	C	97.4	Very high	86.6	Confident	30 Å²	30	79.1 Å²	79.1	20%	0.203	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-67.2	-11.3	176.3	64.6	0	0	0	0	114.8	Y141 F443 L447	Y141-C143 PolarHBondContact O-N 2.85Å; C143-F443 HydrophobicContact CB-CE2 4.16Å; C143-F443 HydrophobicContact CB-CZ 4.21Å; C143-L447 HydrophobicContact CB-CB 3.89Å; C143-L447 HydrophobicContact CB-CD1 3.54Å; C143-L447 HydrophobicContact CB-CG 4.3Å
144	Q	97.8	Very high	89.5	Confident	107 Å²	107	82.2 Å²	82.2	50%	0.5	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-108.3	11.4	174.1	-63.6	-175.3	-54.2	0	0	112.3	S139 Y141 A142 F450	S139-Q144 PolarHBondContact OG-OE1 2.88Å; Y141-Q144 PolarHBondContact O-N 3.16Å; A142-Q144 PolarHBondContact O-N 2.88Å; Q144-F450 HydrophobicContact CG-CE2 4.38Å
145	R	97.1	Very high	92.2	Very high	22 Å²	22	81 Å²	81	8%	0.083	40%	0.396	C	S	.	.	S	Bend	trans	-117.1	142.9	176	-59.4	-168.2	-61.8	-86.8	-0.2	109.8	V138 S139 Q140 Y141 A142 S184 S188	V138-R145 HydrophobicContact CG1-CG 4.48Å; S139-R145 WeakPolarHBondContact O-CD 3.41Å; S139-R145 PolarHBondContact O-NH1 3.04Å; Q140-R145 PolarHBondContact O-NH1 2.79Å; Q140-R145 VanDerWaalsContact O-NH1 3.08Å; Y141-R145 PolarHBondContact O-NH1 2.99Å; A142-R145 VanDerWaalsContact CA-CZ 3.43Å; A142-R145 VanDerWaalsContact CA-NH2 3.33Å; A142-R145 PolarHBondContact O-N 2.96Å; R145-S184 PolarHBondContact NH2-OG 2.97Å; R145-S188 WeakPolarHBondContact CD-OG 3.41Å
146	R	96.5	Very high	94.5	Very high	235 Å²	235	75.9 Å²	75.9	89%	0.887	37%	0.365	S	S	*	.			trans	-87.5	113.2	165.5	-65.9	-179.6	-175	-99.2	1.1	107.5
147	T	97.4	Very high	96.4	Very high	63 Å²	63	68.9 Å²	68.9	39%	0.387	33%	0.328	S	S	.	.			trans	-117.2	108.5	177.4	-50.8	0	0	0	0	107.8	K187 S188	T147-K187 HydrophobicContact CG2-CB 3.84Å; T147-S188 WeakPolarHBondContact OG1-CB 3.26Å
148	T	96.1	Very high	97	Very high	99 Å²	99	64.1 Å²	64.1	61%	0.607	31%	0.311	S	S	*	.			trans	-85.5	178.8	179.8	63.5	0	0	0	0	110.7	E150	T148-E150 PolarHBondContact OG1-N 2.66Å; T148-E150 PolarHBondContact OG1-O 2.88Å
149	I	94.3	Very high	97.3	Very high	94 Å²	94	62.9 Å²	62.9	48%	0.482	30%	0.304	S	S	.	.	S	Bend	trans	-70.5	-25.4	173.7	-64.4	-63.7	0	0	0	111.6	R324 K326	I149-R324 WeakPolarHBondContact CD1-O 3.42Å; I149-K326 HydrophobicContact CD1-CG 3.99Å
150	E	94.9	Very high	97.4	Very high	133 Å²	133	61.8 Å²	61.8	62%	0.621	30%	0.297	S	S	*	.			trans	-71.5	129.1	175.3	-171.1	173.2	-163.2	0	0	110.4	T148	T148-E150 PolarHBondContact OG1-N 2.66Å; T148-E150 PolarHBondContact OG1-O 2.88Å
151	N	96.9	Very high	97.4	Very high	27 Å²	27	62.2 Å²	62.2	14%	0.144	30%	0.299	C	S	.	.			trans	-128.1	104.4	-179.7	177	10.9	0	0	0	109.2	N153 R154 T157	N151-N153 PolarHBondContact O-N 2.94Å; N151-N153 WeakPolarHBondContact OD1-CA 3.44Å; N151-N153 PolarHBondContact OD1-N 2.89Å; N151-R154 HydrophobicContact CB-CG 3.96Å; N151-R154 WeakPolarHBondContact ND2-CG 3.24Å; N151-R154 PolarHBondContact OD1-N 2.91Å; N151-T157 PolarHBondContact ND2-OG1 3.32Å
152	N	97.6	Very high	97.4	Very high	59 Å²	59	62.8 Å²	62.8	32%	0.316	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.7	179	-66.7	-61.5	0	0	0	113.8	L189 P190 A192	N152-L189 PolarHBondContact ND2-O 3.14Å; N152-P190 VanDerWaalsContact ND2-C 3.32Å; N152-P190 PolarHBondContact ND2-O 3.13Å; N152-A192 HydrophobicContact CB-CB 4.31Å; N152-A192 WeakPolarHBondContact O-CB 3.49Å
153	N	98.3	Very high	97.4	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.011	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	26.8	-169	-66.4	-67.3	0	0	0	112.5	N151 I155 F156 T157 L186 W191 V193	N151-N153 PolarHBondContact O-N 2.94Å; N151-N153 WeakPolarHBondContact OD1-CA 3.44Å; N151-N153 PolarHBondContact OD1-N 2.89Å; N153-I155 VanDerWaalsContact C-N 3.27Å; N153-I155 PolarHBondContact O-N 2.8Å; N153-F156 HydrophobicContact CB-CD2 4.18Å; N153-F156 PolarHBondContact O-N 2.73Å; N153-T157 HydrophobicContact CB-CG2 4.42Å; N153-T157 WeakPolarHBondContact O-CG2 3.4Å; N153-T157 PolarHBondContact O-N 2.94Å; N153-L186 HydrophobicContact CB-CB 4.03Å; N153-L186 PolarHBondContact ND2-O 3Å; N153-W191 PolarHBondContact ND2-O 2.68Å; N153-V193 WeakPolarHBondContact OD1-CG2 3.44Å; N153-V193 PolarHBondContact OD1-N 2.9Å
154	R	98	Very high	97.4	Very high	151 Å²	151	61.4 Å²	61.4	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-49.1	-43.7	-178	-77.1	-178.2	-176	-151.2	1.4	113.7	N151 F156 T157 D158	N151-R154 HydrophobicContact CB-CG 3.96Å; N151-R154 WeakPolarHBondContact ND2-CG 3.24Å; N151-R154 PolarHBondContact OD1-N 2.91Å; R154-F156 PolarHBondContact O-N 3.05Å; R154-F156 VanDerWaalsContact O-N 3.08Å; R154-T157 WeakPolarHBondContact CA-OG1 3.15Å; R154-T157 PolarHBondContact O-N 2.83Å; R154-T157 VanDerWaalsContact O-N 3.12Å; R154-T157 PolarHBondContact O-OG1 3.39Å; R154-D158 VanDerWaalsContact O-CB 3.29Å; R154-D158 WeakPolarHBondContact O-CB 3.12Å; R154-D158 PolarHBondContact O-N 3.04Å
155	I	97.7	Very high	97.2	Very high	90 Å²	90	59.2 Å²	59.2	46%	0.462	28%	0.283	S	S	.	.	H	α-helix	trans	-54.2	-34.3	179.8	-160.2	177.9	0	0	0	113.1	N153 I216	N153-I155 VanDerWaalsContact C-N 3.27Å; N153-I155 PolarHBondContact O-N 2.8Å; I155-I216 HydrophobicContact CB-CG2 4.35Å; I155-I216 HydrophobicContact CD1-CG2 3.51Å; I155-I216 HydrophobicContact CG1-CG2 3.54Å; I155-I216 HydrophobicContact CG2-CG2 4.08Å
156	F	98.6	Very high	97.2	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.018	29%	0.286	C	S	.	.	H	α-helix	trans	-88.3	-42.8	175.8	-53.5	-64.2	0	0	0	112	N153 R154 D158 A159 F160 L186 V193 M213 I216 L217	N153-F156 HydrophobicContact CB-CD2 4.18Å; N153-F156 PolarHBondContact O-N 2.73Å; R154-F156 PolarHBondContact O-N 3.05Å; R154-F156 VanDerWaalsContact O-N 3.08Å; F156-D158 VanDerWaalsContact C-N 3.33Å; F156-D158 PolarHBondContact O-N 3Å; F156-A159 PolarHBondContact O-N 2.8Å; F156-F160 WeakPolarHBondContact O-CB 3.46Å; F156-F160 WeakPolarHBondContact O-CD1 3.36Å; F156-F160 WeakPolarHBondContact O-CG 3.43Å; F156-F160 PolarHBondContact O-N 3.18Å; F156-L186 HydrophobicContact CB-CD1 3.64Å; F156-L186 HydrophobicContact CD2-CD1 4.45Å; F156-L186 HydrophobicContact CG-CD1 4.27Å; F156-V193 HydrophobicContact CD2-CB 4.47Å; F156-V193 HydrophobicContact CE2-CB 3.83Å; F156-V193 HydrophobicContact CE2-CG1 4.34Å; F156-M213 HydrophobicContact CD1-CB 4.03Å; F156-M213 HydrophobicContact CD1-CE 4.38Å; F156-M213 HydrophobicContact CD1-CG 3.69Å; F156-M213 HydrophobicContact CD2-CE 4.32Å; F156-M213 HydrophobicContact CE1-CB 4Å; F156-M213 HydrophobicContact CE1-CE 4.5Å; F156-M213 HydrophobicContact CE1-CG 4.14Å; F156-M213 HydrophobicContact CE2-CE 4.46Å; F156-M213 HydrophobicContact CG-CE 4.29Å; F156-M213 HydrophobicContact CG-CG 4.2Å; F156-I216 HydrophobicContact CD1-CB 4.06Å; F156-I216 HydrophobicContact CD1-CD1 3.98Å; F156-I216 HydrophobicContact CD1-CG2 3.8Å; F156-I216 HydrophobicContact CE1-CB 3.82Å; F156-I216 HydrophobicContact CE1-CG2 3.52Å; F156-I216 HydrophobicContact CZ-CG2 4.37Å; F156-L217 HydrophobicContact CE1-CD2 4.42Å; F156-L217 HydrophobicContact CE1-CG 3.98Å; F156-L217 HydrophobicContact CZ-CD1 4.34Å; F156-L217 HydrophobicContact CZ-CD2 3.72Å; F156-L217 HydrophobicContact CZ-CG 3.74Å
157	T	98.4	Very high	97.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.2	-36.4	-173.9	61.1	0	0	0	0	111.9	N151 N153 R154 F160 E161 A183 L186 K187	N151-T157 PolarHBondContact ND2-OG1 3.32Å; N153-T157 HydrophobicContact CB-CG2 4.42Å; N153-T157 WeakPolarHBondContact O-CG2 3.4Å; N153-T157 PolarHBondContact O-N 2.94Å; R154-T157 WeakPolarHBondContact CA-OG1 3.15Å; R154-T157 PolarHBondContact O-N 2.83Å; R154-T157 VanDerWaalsContact O-N 3.12Å; R154-T157 PolarHBondContact O-OG1 3.39Å; T157-F160 PolarHBondContact O-N 2.97Å; T157-E161 VanDerWaalsContact O-CG 3.32Å; T157-E161 WeakPolarHBondContact O-CG 3.37Å; T157-E161 PolarHBondContact O-N 3.27Å; T157-A183 HydrophobicContact CG2-CB 4.42Å; T157-L186 HydrophobicContact CG2-CB 3.9Å; T157-K187 HydrophobicContact CG2-CG 3.73Å
158	D	98.3	Very high	96.8	Very high	80 Å²	80	49.8 Å²	49.8	43%	0.428	25%	0.247	S	C	.	.	H	α-helix	trans	-70.4	-41.1	-179.8	-59.7	1.1	0	0	0	109.4	R154 F156 F160 E161 V162	R154-D158 VanDerWaalsContact O-CB 3.29Å; R154-D158 WeakPolarHBondContact O-CB 3.12Å; R154-D158 PolarHBondContact O-N 3.04Å; F156-D158 VanDerWaalsContact C-N 3.33Å; F156-D158 PolarHBondContact O-N 3Å; D158-F160 PolarHBondContact O-N 2.8Å; D158-E161 PolarHBondContact O-N 2.77Å; D158-V162 WeakPolarHBondContact O-CG2 3.37Å; D158-V162 PolarHBondContact O-N 2.76Å; D158-V162 VanDerWaalsContact O-N 3.1Å
159	A	98.6	Very high	96.5	Very high	10 Å²	10	46.1 Å²	46.1	8%	0.083	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-45.4	170.3	0	0	0	0	0	112.3	F156 E161 V162 L163 I216 V225	F156-A159 PolarHBondContact O-N 2.8Å; A159-E161 VanDerWaalsContact C-N 3.32Å; A159-E161 PolarHBondContact O-N 2.8Å; A159-V162 PolarHBondContact O-N 3.36Å; A159-L163 WeakPolarHBondContact O-CG 3.46Å; A159-L163 PolarHBondContact O-N 3Å; A159-L163 VanDerWaalsContact O-N 3.07Å; A159-I216 HydrophobicContact CB-CD1 3.62Å; A159-V225 HydrophobicContact CB-CG2 3.93Å
160	F	98.6	Very high	96.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-31.6	177.5	-69.8	-6.7	0	0	0	113	F156 T157 D158 L163 A164 F179 A182 A183 L186 L205 T209 V212 M213	F156-F160 WeakPolarHBondContact O-CB 3.46Å; F156-F160 WeakPolarHBondContact O-CD1 3.36Å; F156-F160 WeakPolarHBondContact O-CG 3.43Å; F156-F160 PolarHBondContact O-N 3.18Å; T157-F160 PolarHBondContact O-N 2.97Å; D158-F160 PolarHBondContact O-N 2.8Å; F160-L163 HydrophobicContact CD1-CD1 4.33Å; F160-L163 PolarHBondContact O-N 2.98Å; F160-A164 VanDerWaalsContact O-CB 3.25Å; F160-A164 WeakPolarHBondContact O-CB 3.45Å; F160-A164 PolarHBondContact O-N 2.74Å; F160-F179 HydrophobicContact CB-CB 4.47Å; F160-F179 HydrophobicContact CB-CD1 4.07Å; F160-F179 AromaticContact CD1-CD1 3.66Å; F160-F179 HydrophobicContact CD1-CD1 3.66Å; F160-F179 AromaticContact CD1-CE1 3.87Å; F160-F179 HydrophobicContact CD1-CE1 3.87Å; F160-F179 HydrophobicContact CE1-CD1 4.21Å; F160-F179 HydrophobicContact CE1-CE1 4.08Å; F160-F179 AromaticContact CG-CD1 3.87Å; F160-F179 HydrophobicContact CG-CD1 3.87Å; F160-A182 HydrophobicContact CD2-CB 3.85Å; F160-A182 HydrophobicContact CE2-CB 3.71Å; F160-A183 HydrophobicContact CB-CB 4.01Å; F160-A183 HydrophobicContact CD2-CB 4.23Å; F160-L186 HydrophobicContact CD2-CD1 4.22Å; F160-L186 HydrophobicContact CE2-CD1 3.61Å; F160-L186 HydrophobicContact CZ-CD1 4.42Å; F160-L205 HydrophobicContact CE2-CD2 4.5Å; F160-T209 HydrophobicContact CE1-CG2 4.32Å; F160-T209 HydrophobicContact CE2-CG2 4.31Å; F160-T209 HydrophobicContact CZ-CG2 4.01Å; F160-V212 HydrophobicContact CD1-CG1 4.22Å; F160-V212 HydrophobicContact CE1-CB 4.03Å; F160-V212 HydrophobicContact CE1-CG1 3.77Å; F160-M213 HydrophobicContact CE1-CG 4.3Å; F160-M213 HydrophobicContact CE2-CG 4.49Å; F160-M213 HydrophobicContact CE2-SD 4.4Å; F160-M213 HydrophobicContact CZ-CG 3.63Å; F160-M213 HydrophobicContact CZ-SD 3.97Å
161	E	97.8	Very high	96.1	Very high	90 Å²	90	45.9 Å²	45.9	42%	0.421	22%	0.221	S	C	.	.	H	α-helix	trans	-66.5	-43.4	173.9	-78.2	178	178.2	0	0	111.5	T157 D158 A159 L163 A164 E165 K187	T157-E161 VanDerWaalsContact O-CG 3.32Å; T157-E161 WeakPolarHBondContact O-CG 3.37Å; T157-E161 PolarHBondContact O-N 3.27Å; D158-E161 PolarHBondContact O-N 2.77Å; A159-E161 VanDerWaalsContact C-N 3.32Å; A159-E161 PolarHBondContact O-N 2.8Å; E161-L163 VanDerWaalsContact C-N 3.35Å; E161-L163 PolarHBondContact O-N 3.45Å; E161-A164 PolarHBondContact O-N 3.05Å; E161-E165 VanDerWaalsContact O-CB 3.31Å; E161-E165 WeakPolarHBondContact O-CB 3.25Å; E161-E165 PolarHBondContact O-N 3.18Å; E161-K187 WeakPolarHBondContact OE1-CE 3.45Å; E161-K187 IonicContact OE1-NZ 3.52Å; E161-K187 PolarHBondContact OE1-NZ 3.39Å
162	V	97.6	Very high	96	Very high	20 Å²	20	48.1 Å²	48.1	12%	0.121	23%	0.233	C	C	.	.	H	α-helix	trans	-59.7	-45.7	173.8	174.6	0	0	0	0	111.2	D158 A159 E165 N166 V225 I228 L229	D158-V162 WeakPolarHBondContact O-CG2 3.37Å; D158-V162 PolarHBondContact O-N 2.76Å; D158-V162 VanDerWaalsContact O-N 3.1Å; A159-V162 PolarHBondContact O-N 3.36Å; V162-E165 PolarHBondContact O-N 2.82Å; V162-N166 WeakPolarHBondContact O-CB 3.42Å; V162-N166 PolarHBondContact O-N 2.89Å; V162-V225 HydrophobicContact CB-CG1 4.09Å; V162-V225 HydrophobicContact CG1-CG1 3.98Å; V162-V225 HydrophobicContact CG2-CG1 4.3Å; V162-I228 HydrophobicContact CG1-CB 4.3Å; V162-I228 HydrophobicContact CG1-CG2 3.73Å; V162-L229 HydrophobicContact CG1-CD2 3.94Å; V162-L229 HydrophobicContact CG1-CG 4.15Å; V162-L229 HydrophobicContact CG2-CD2 4.03Å
163	L	97.9	Very high	95.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-46.5	177.4	-69.7	165.9	0	0	0	111.4	A159 F160 E161 E165 N166 Y167 F179 V212 E224 V225 I228	A159-L163 WeakPolarHBondContact O-CG 3.46Å; A159-L163 PolarHBondContact O-N 3Å; A159-L163 VanDerWaalsContact O-N 3.07Å; F160-L163 HydrophobicContact CD1-CD1 4.33Å; F160-L163 PolarHBondContact O-N 2.98Å; E161-L163 VanDerWaalsContact C-N 3.35Å; E161-L163 PolarHBondContact O-N 3.45Å; L163-E165 VanDerWaalsContact C-N 3.35Å; L163-E165 PolarHBondContact O-N 2.89Å; L163-N166 PolarHBondContact O-N 3.17Å; L163-Y167 HydrophobicContact CB-CE2 4.45Å; L163-Y167 WeakPolarHBondContact O-CD2 3.43Å; L163-Y167 PolarHBondContact O-N 2.89Å; L163-F179 HydrophobicContact CB-CD1 4.08Å; L163-F179 HydrophobicContact CB-CD2 4.09Å; L163-F179 HydrophobicContact CB-CE1 4.18Å; L163-F179 HydrophobicContact CB-CE2 4.21Å; L163-F179 HydrophobicContact CB-CG 4.04Å; L163-F179 HydrophobicContact CB-CZ 4.24Å; L163-F179 HydrophobicContact CD1-CD1 4.01Å; L163-F179 HydrophobicContact CD1-CE1 3.45Å; L163-F179 VanDerWaalsContact CD1-CE1 3.45Å; L163-F179 HydrophobicContact CD1-CZ 3.76Å; L163-F179 HydrophobicContact CG-CE1 4.41Å; L163-F179 HydrophobicContact CG-CZ 4.49Å; L163-V212 HydrophobicContact CD1-CG1 4.14Å; L163-V212 HydrophobicContact CD1-CG2 4.03Å; L163-E224 VanDerWaalsContact CD2-CD 3.49Å; L163-E224 HydrophobicContact CD2-CG 3.8Å; L163-E224 WeakPolarHBondContact CD2-OE1 3.38Å; L163-V225 HydrophobicContact CD1-CG2 4.07Å; L163-V225 HydrophobicContact CD2-CG2 4.28Å; L163-V225 HydrophobicContact CG-CG2 3.94Å; L163-I228 HydrophobicContact CD2-CD1 3.58Å
164	A	97.2	Very high	95.6	Very high	4 Å²	4	55.8 Å²	55.8	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-44.1	179.2	0	0	0	0	0	112.3	F160 E161 Y167 E168 C176 F179 R180	F160-A164 VanDerWaalsContact O-CB 3.25Å; F160-A164 WeakPolarHBondContact O-CB 3.45Å; F160-A164 PolarHBondContact O-N 2.74Å; E161-A164 PolarHBondContact O-N 3.05Å; A164-Y167 PolarHBondContact O-N 2.77Å; A164-E168 PolarHBondContact O-N 3.42Å; A164-C176 PolarHBondContact O-SG 2.93Å; A164-F179 HydrophobicContact CB-CB 3.91Å; A164-R180 HydrophobicContact CB-CG 3.88Å
165	E	94.6	Very high	95.4	Very high	60 Å²	60	54.9 Å²	54.9	28%	0.28	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-42.8	177.5	-172.5	-177.2	-163.9	0	0	111.7	E161 V162 L163 Y167 E168 F169 K238	E161-E165 VanDerWaalsContact O-CB 3.31Å; E161-E165 WeakPolarHBondContact O-CB 3.25Å; E161-E165 PolarHBondContact O-N 3.18Å; V162-E165 PolarHBondContact O-N 2.82Å; L163-E165 VanDerWaalsContact C-N 3.35Å; L163-E165 PolarHBondContact O-N 2.89Å; E165-Y167 VanDerWaalsContact C-N 3.34Å; E165-Y167 PolarHBondContact O-N 2.93Å; E165-E168 WeakPolarHBondContact O-CB 3.44Å; E165-E168 PolarHBondContact O-N 2.95Å; E165-E168 VanDerWaalsContact O-N 3.12Å; E165-F169 HydrophobicContact CG-CD2 4.27Å; E165-F169 HydrophobicContact CG-CE2 3.66Å; E165-F169 HydrophobicContact CG-CZ 4.02Å; E165-F169 WeakPolarHBondContact O-CD2 3.29Å; E165-F169 PolarHBondContact O-N 3.22Å; E165-K238 WeakPolarHBondContact OE1-CE 3.2Å; E165-K238 IonicContact OE1-NZ 3Å; E165-K238 WeakPolarHBondContact OE2-CE 3.42Å; E165-K238 IonicContact OE2-NZ 3.61Å; E165-K238 PolarHBondContact OE2-NZ 3.49Å
166	N	95.2	Very high	95.3	Very high	27 Å²	27	50.8 Å²	50.8	14%	0.144	26%	0.258	C	S	.	.	H	α-helix	trans	-60.1	-44.2	173.5	179.1	63.8	0	0	0	111.8	V162 L163 E168 F169 N170 I228	V162-N166 WeakPolarHBondContact O-CB 3.42Å; V162-N166 PolarHBondContact O-N 2.89Å; L163-N166 PolarHBondContact O-N 3.17Å; N166-E168 VanDerWaalsContact C-N 3.27Å; N166-E168 PolarHBondContact O-N 2.63Å; N166-F169 PolarHBondContact O-N 3.07Å; N166-N170 PolarHBondContact O-N 3.19Å; N166-N170 VanDerWaalsContact O-N 3.12Å; N166-N170 PolarHBondContact O-ND2 2.78Å; N166-N170 PolarHBondContact OD1-ND2 3.22Å; N166-I228 HydrophobicContact CB-CD1 4.03Å; N166-I228 HydrophobicContact CB-CG1 4.49Å; N166-I228 HydrophobicContact CB-CG2 3.85Å
167	Y	95.1	Very high	95.2	Very high	14 Å²	14	52.6 Å²	52.6	6%	0.055	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-30.7	175.5	-75.1	-59.9	0	0	0	112.8	L163 A164 E165 N170 E171 I172 R175 F179 H208	L163-Y167 HydrophobicContact CB-CE2 4.45Å; L163-Y167 WeakPolarHBondContact O-CD2 3.43Å; L163-Y167 PolarHBondContact O-N 2.89Å; A164-Y167 PolarHBondContact O-N 2.77Å; E165-Y167 VanDerWaalsContact C-N 3.34Å; E165-Y167 PolarHBondContact O-N 2.93Å; Y167-N170 CarbonylContact O-C 3.58Å; Y167-N170 PolarHBondContact O-N 3.33Å; Y167-E171 PolarHBondContact O-N 2.83Å; Y167-I172 HydrophobicContact CD1-CB 3.92Å; Y167-I172 HydrophobicContact CD1-CD1 4.02Å; Y167-I172 HydrophobicContact CD1-CG1 4.39Å; Y167-I172 HydrophobicContact CD1-CG2 4.17Å; Y167-I172 HydrophobicContact CE1-CD1 4.34Å; Y167-I172 PolarHBondContact O-N 3.06Å; Y167-R175 HydrophobicContact CD1-CB 3.78Å; Y167-R175 HydrophobicContact CD1-CG 4.46Å; Y167-R175 HydrophobicContact CD2-CB 3.79Å; Y167-R175 HydrophobicContact CE1-CB 4.02Å; Y167-R175 HydrophobicContact CE1-CG 4.32Å; Y167-R175 HydrophobicContact CE2-CB 4.09Å; Y167-R175 HydrophobicContact CG-CB 3.67Å; Y167-R175 PolarHBondContact OH-NH1 3.08Å; Y167-R175 VanDerWaalsContact OH-NH1 3.13Å; Y167-F179 AromaticContact CD2-CD2 3.85Å; Y167-F179 HydrophobicContact CD2-CD2 3.85Å; Y167-F179 AromaticContact CD2-CE2 3.99Å; Y167-F179 HydrophobicContact CD2-CE2 3.99Å; Y167-F179 AromaticContact CE2-CD2 3.81Å; Y167-F179 HydrophobicContact CE2-CD2 3.81Å; Y167-F179 AromaticContact CE2-CE2 3.44Å; Y167-F179 HydrophobicContact CE2-CE2 3.44Å; Y167-F179 VanDerWaalsContact CE2-CE2 3.44Å; Y167-F179 HydrophobicContact CE2-CZ 4.45Å; Y167-H208 PolarHBondContact OH-CE1 3.36Å
168	E	91.9	Very high	95.2	Very high	82 Å²	82	54.8 Å²	54.8	38%	0.383	29%	0.286	S	S	.	.	H	α-helix	trans	-66	-45.1	172.4	-177.1	166.2	-121.7	0	0	111.8	A164 E165 N166 N170 E171 R180	A164-E168 PolarHBondContact O-N 3.42Å; E165-E168 WeakPolarHBondContact O-CB 3.44Å; E165-E168 PolarHBondContact O-N 2.95Å; E165-E168 VanDerWaalsContact O-N 3.12Å; N166-E168 VanDerWaalsContact C-N 3.27Å; N166-E168 PolarHBondContact O-N 2.63Å; E168-N170 PolarHBondContact O-N 3.35Å; E168-E171 PolarHBondContact O-N 3.47Å; E168-R180 IonicContact OE1-CZ 3.54Å; E168-R180 IonicContact OE1-NH1 2.78Å; E168-R180 IonicContact OE1-NH2 3.62Å; E168-R180 PolarHBondContact OE1-NH2 3.24Å; E168-R180 IonicContact OE2-NH2 3.88Å; E168-R180 PolarHBondContact OE2-NH2 3.26Å
169	F	89.8	Confident	95.2	Very high	22 Å²	22	51.2 Å²	51.2	10%	0.096	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-26.3	174.9	-68.8	-43.6	0	0	0	113.9	E165 N166 L237 K238 T241	E165-F169 HydrophobicContact CG-CD2 4.27Å; E165-F169 HydrophobicContact CG-CE2 3.66Å; E165-F169 HydrophobicContact CG-CZ 4.02Å; E165-F169 WeakPolarHBondContact O-CD2 3.29Å; E165-F169 PolarHBondContact O-N 3.22Å; N166-F169 PolarHBondContact O-N 3.07Å; F169-L237 HydrophobicContact CB-CD1 4.03Å; F169-L237 HydrophobicContact CD1-CB 4.32Å; F169-L237 HydrophobicContact CD1-CD1 4.34Å; F169-L237 HydrophobicContact CD2-CB 4.49Å; F169-L237 HydrophobicContact CE1-CB 4.26Å; F169-L237 HydrophobicContact CE2-CB 4.41Å; F169-L237 HydrophobicContact CG-CB 4.46Å; F169-L237 HydrophobicContact CG-CD1 4.1Å; F169-L237 HydrophobicContact CZ-CB 4.31Å; F169-K238 HydrophobicContact CE2-CG 3.8Å; F169-K238 HydrophobicContact CZ-CG 4.02Å; F169-T241 HydrophobicContact CE1-CG2 4.21Å
170	N	90	Very high	95.2	Very high	70 Å²	70	54.2 Å²	54.2	37%	0.374	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	8.6	176.7	-68.3	-74.1	0	0	0	113	N166 Y167 E168 I172	N166-N170 PolarHBondContact O-N 3.19Å; N166-N170 VanDerWaalsContact O-N 3.12Å; N166-N170 PolarHBondContact O-ND2 2.78Å; N166-N170 PolarHBondContact OD1-ND2 3.22Å; Y167-N170 CarbonylContact O-C 3.58Å; Y167-N170 PolarHBondContact O-N 3.33Å; E168-N170 PolarHBondContact O-N 3.35Å; N170-I172 HydrophobicContact CB-CD1 4.23Å; N170-I172 HydrophobicContact CB-CG1 4.06Å; N170-I172 WeakPolarHBondContact O-CG1 3.39Å; N170-I172 PolarHBondContact O-N 3Å
171	E	91	Very high	95.2	Very high	152 Å²	152	57 Å²	57	71%	0.71	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	28.2	179.6	-56	-175.7	160.5	0	0	113.6	Y167 E168 E173	Y167-E171 PolarHBondContact O-N 2.83Å; E168-E171 PolarHBondContact O-N 3.47Å; E171-E173 PolarHBondContact O-N 3.14Å
172	I	94	Very high	95.2	Very high	74 Å²	74	52.8 Å²	52.8	38%	0.379	27%	0.266	S	S	.	.			trans	-97.3	71.7	177.7	-48.2	-174	0	0	0	109.5	Y167 N170 G174 R175 C176	Y167-I172 HydrophobicContact CD1-CB 3.92Å; Y167-I172 HydrophobicContact CD1-CD1 4.02Å; Y167-I172 HydrophobicContact CD1-CG1 4.39Å; Y167-I172 HydrophobicContact CD1-CG2 4.17Å; Y167-I172 HydrophobicContact CE1-CD1 4.34Å; Y167-I172 PolarHBondContact O-N 3.06Å; N170-I172 HydrophobicContact CB-CD1 4.23Å; N170-I172 HydrophobicContact CB-CG1 4.06Å; N170-I172 WeakPolarHBondContact O-CG1 3.39Å; N170-I172 PolarHBondContact O-N 3Å; I172-G174 VanDerWaalsContact C-N 3.32Å; I172-G174 PolarHBondContact O-N 2.69Å; I172-R175 HydrophobicContact CG2-CB 3.99Å; I172-R175 HydrophobicContact CG2-CG 3.94Å; I172-R175 PolarHBondContact O-N 2.77Å; I172-C176 PolarHBondContact O-N 2.93Å; I172-C176 VanDerWaalsContact O-N 3.16Å
173	E	91.7	Very high	95.3	Very high	164 Å²	164	52 Å²	52	77%	0.766	26%	0.262	S	S	*	.	H	α-helix	trans	-55.5	-42	-172.1	-65.8	-173.1	168.5	0	0	113.5	E171 R175 C176 L177	E171-E173 PolarHBondContact O-N 3.14Å; E173-R175 PolarHBondContact O-N 2.76Å; E173-C176 WeakPolarHBondContact O-CB 3.26Å; E173-C176 PolarHBondContact O-N 2.97Å; E173-L177 VanDerWaalsContact O-CB 3.3Å; E173-L177 WeakPolarHBondContact O-CB 3.22Å; E173-L177 PolarHBondContact O-N 2.75Å
174	G	94.6	Very high	95.3	Very high	58 Å²	58	52.6 Å²	52.6	60%	0.598	27%	0.266	S	S	*	.	H	α-helix	trans	-60.7	-43.4	-176.7	0	0	0	0	0	113.4	I172 A178	I172-G174 VanDerWaalsContact C-N 3.32Å; I172-G174 PolarHBondContact O-N 2.69Å; G174-A178 PolarHBondContact O-N 2.79Å; G174-A178 VanDerWaalsContact O-N 3.1Å
175	R	95.2	Very high	95.3	Very high	131 Å²	131	52.4 Å²	52.4	49%	0.494	26%	0.264	S	S	.	.	H	α-helix	trans	-73.6	-42.3	178.2	-70	-169.9	-178	-168.4	3.7	111.5	Y167 I172 E173 L177 A178 F179	Y167-R175 HydrophobicContact CD1-CB 3.78Å; Y167-R175 HydrophobicContact CD1-CG 4.46Å; Y167-R175 HydrophobicContact CD2-CB 3.79Å; Y167-R175 HydrophobicContact CE1-CB 4.02Å; Y167-R175 HydrophobicContact CE1-CG 4.32Å; Y167-R175 HydrophobicContact CE2-CB 4.09Å; Y167-R175 HydrophobicContact CG-CB 3.67Å; Y167-R175 PolarHBondContact OH-NH1 3.08Å; Y167-R175 VanDerWaalsContact OH-NH1 3.13Å; I172-R175 HydrophobicContact CG2-CB 3.99Å; I172-R175 HydrophobicContact CG2-CG 3.94Å; I172-R175 PolarHBondContact O-N 2.77Å; E173-R175 PolarHBondContact O-N 2.76Å; R175-L177 PolarHBondContact O-N 3.01Å; R175-A178 WeakPolarHBondContact O-CB 3.44Å; R175-A178 PolarHBondContact O-N 3.4Å; R175-A178 VanDerWaalsContact O-N 3.13Å; R175-F179 WeakPolarHBondContact O-CD2 3.28Å; R175-F179 PolarHBondContact O-N 2.98Å; R175-F179 VanDerWaalsContact O-N 3.08Å
176	C	96	Very high	95.5	Very high	4 Å²	4	49.5 Å²	49.5	3%	0.027	25%	0.251	C	S	.	.	H	α-helix	trans	-51.1	-47.6	172	171.8	0	0	0	0	110.9	A164 I172 E173 A178 F179 R180	A164-C176 PolarHBondContact O-SG 2.93Å; I172-C176 PolarHBondContact O-N 2.93Å; I172-C176 VanDerWaalsContact O-N 3.16Å; E173-C176 WeakPolarHBondContact O-CB 3.26Å; E173-C176 PolarHBondContact O-N 2.97Å; C176-A178 PolarHBondContact O-N 3.4Å; C176-F179 PolarHBondContact O-N 3.47Å; C176-R180 WeakPolarHBondContact O-CG 3.36Å; C176-R180 PolarHBondContact O-N 3.42Å; C176-R180 PolarHBondContact SG-NE 3.48Å; C176-R180 VanDerWaalsContact SG-NE 3.41Å; C176-R180 PolarHBondContact SG-NH1 3.15Å
177	L	96.4	Very high	95.7	Very high	43 Å²	43	51.1 Å²	51.1	23%	0.225	26%	0.257	C	S	.	.	H	α-helix	trans	-65.4	-38.4	179.4	-162.3	63.1	0	0	0	113.9	E173 R175 R180 R181 R445	E173-L177 VanDerWaalsContact O-CB 3.3Å; E173-L177 WeakPolarHBondContact O-CB 3.22Å; E173-L177 PolarHBondContact O-N 2.75Å; R175-L177 PolarHBondContact O-N 3.01Å; L177-R180 PolarHBondContact O-N 3.46Å; L177-R181 WeakPolarHBondContact O-CG 3.5Å; L177-R181 PolarHBondContact O-N 3.04Å; L177-R445 VanDerWaalsContact CD2-NH1 3.3Å
178	A	97.8	Very high	95.8	Very high	46 Å²	46	51.3 Å²	51.3	38%	0.38	26%	0.26	S	S	.	.	H	α-helix	trans	-62	-49.2	177.4	0	0	0	0	0	111	G174 R175 C176 R180 R181 A182	G174-A178 PolarHBondContact O-N 2.79Å; G174-A178 VanDerWaalsContact O-N 3.1Å; R175-A178 WeakPolarHBondContact O-CB 3.44Å; R175-A178 PolarHBondContact O-N 3.4Å; R175-A178 VanDerWaalsContact O-N 3.13Å; C176-A178 PolarHBondContact O-N 3.4Å; A178-R180 PolarHBondContact O-N 3.25Å; A178-R181 PolarHBondContact O-N 2.69Å; A178-A182 WeakPolarHBondContact O-CB 3.27Å; A178-A182 PolarHBondContact O-N 2.95Å
179	F	98.5	Very high	96	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.022	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-40.2	176.9	-78.9	-72.5	0	0	0	112.5	F160 L163 A164 Y167 R175 C176 R181 A182 A183 H208 T209	F160-F179 HydrophobicContact CB-CB 4.47Å; F160-F179 HydrophobicContact CB-CD1 4.07Å; F160-F179 AromaticContact CD1-CD1 3.66Å; F160-F179 HydrophobicContact CD1-CD1 3.66Å; F160-F179 AromaticContact CD1-CE1 3.87Å; F160-F179 HydrophobicContact CD1-CE1 3.87Å; F160-F179 HydrophobicContact CE1-CD1 4.21Å; F160-F179 HydrophobicContact CE1-CE1 4.08Å; F160-F179 AromaticContact CG-CD1 3.87Å; F160-F179 HydrophobicContact CG-CD1 3.87Å; L163-F179 HydrophobicContact CB-CD1 4.08Å; L163-F179 HydrophobicContact CB-CD2 4.09Å; L163-F179 HydrophobicContact CB-CE1 4.18Å; L163-F179 HydrophobicContact CB-CE2 4.21Å; L163-F179 HydrophobicContact CB-CG 4.04Å; L163-F179 HydrophobicContact CB-CZ 4.24Å; L163-F179 HydrophobicContact CD1-CD1 4.01Å; L163-F179 HydrophobicContact CD1-CE1 3.45Å; L163-F179 VanDerWaalsContact CD1-CE1 3.45Å; L163-F179 HydrophobicContact CD1-CZ 3.76Å; L163-F179 HydrophobicContact CG-CE1 4.41Å; L163-F179 HydrophobicContact CG-CZ 4.49Å; A164-F179 HydrophobicContact CB-CB 3.91Å; Y167-F179 AromaticContact CD2-CD2 3.85Å; Y167-F179 HydrophobicContact CD2-CD2 3.85Å; Y167-F179 AromaticContact CD2-CE2 3.99Å; Y167-F179 HydrophobicContact CD2-CE2 3.99Å; Y167-F179 AromaticContact CE2-CD2 3.81Å; Y167-F179 HydrophobicContact CE2-CD2 3.81Å; Y167-F179 AromaticContact CE2-CE2 3.44Å; Y167-F179 HydrophobicContact CE2-CE2 3.44Å; Y167-F179 VanDerWaalsContact CE2-CE2 3.44Å; Y167-F179 HydrophobicContact CE2-CZ 4.45Å; R175-F179 WeakPolarHBondContact O-CD2 3.28Å; R175-F179 PolarHBondContact O-N 2.98Å; R175-F179 VanDerWaalsContact O-N 3.08Å; C176-F179 PolarHBondContact O-N 3.47Å; F179-R181 VanDerWaalsContact C-N 3.35Å; F179-R181 PolarHBondContact O-N 3.32Å; F179-A182 PolarHBondContact O-N 2.89Å; F179-A183 WeakPolarHBondContact O-CB 3.35Å; F179-A183 PolarHBondContact O-N 3.04Å; F179-H208 AromaticContact CZ-ND1 3.94Å; F179-T209 HydrophobicContact CD1-CG2 3.67Å; F179-T209 HydrophobicContact CE1-CG2 3.56Å; F179-T209 HydrophobicContact CG-CG2 4.47Å; F179-T209 HydrophobicContact CZ-CG2 4.28Å
180	R	98.3	Very high	96.3	Very high	73 Å²	73	52.1 Å²	52.1	28%	0.275	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-40.2	174.2	-73.2	176.2	177.6	166.3	-1.2	112.6	A164 E168 C176 L177 A178 S184 M442	A164-R180 HydrophobicContact CB-CG 3.88Å; E168-R180 IonicContact OE1-CZ 3.54Å; E168-R180 IonicContact OE1-NH1 2.78Å; E168-R180 IonicContact OE1-NH2 3.62Å; E168-R180 PolarHBondContact OE1-NH2 3.24Å; E168-R180 IonicContact OE2-NH2 3.88Å; E168-R180 PolarHBondContact OE2-NH2 3.26Å; C176-R180 WeakPolarHBondContact O-CG 3.36Å; C176-R180 PolarHBondContact O-N 3.42Å; C176-R180 PolarHBondContact SG-NE 3.48Å; C176-R180 VanDerWaalsContact SG-NE 3.41Å; C176-R180 PolarHBondContact SG-NH1 3.15Å; L177-R180 PolarHBondContact O-N 3.46Å; A178-R180 PolarHBondContact O-N 3.25Å; R180-S184 VanDerWaalsContact O-CB 3.3Å; R180-S184 WeakPolarHBondContact O-CB 3.26Å; R180-S184 PolarHBondContact O-N 2.66Å; R180-M442 HydrophobicContact CB-CG 4.39Å; R180-M442 HydrophobicContact CB-SD 3.79Å
181	R	98.4	Very high	96.5	Very high	59 Å²	59	53.7 Å²	53.7	22%	0.223	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-46.2	174.7	-77.4	179.8	168.6	150.2	3.3	111.6	L177 A178 F179 S184 V185 C204 M442 R445	L177-R181 WeakPolarHBondContact O-CG 3.5Å; L177-R181 PolarHBondContact O-N 3.04Å; A178-R181 PolarHBondContact O-N 2.69Å; F179-R181 VanDerWaalsContact C-N 3.35Å; F179-R181 PolarHBondContact O-N 3.32Å; R181-S184 WeakPolarHBondContact O-CB 3.36Å; R181-S184 PolarHBondContact O-N 3.08Å; R181-V185 PolarHBondContact O-N 2.86Å; R181-C204 HydrophobicContact CB-CB 3.8Å; R181-M442 HydrophobicContact CB-CE 4.46Å; R181-M442 HydrophobicContact CG-CE 3.77Å; R181-R445 VanDerWaalsContact NH2-NH1 3.18Å
182	A	98.4	Very high	96.8	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-50.2	177.2	0	0	0	0	0	111.5	F160 A178 F179 S184 V185 L186 L205 T209	F160-A182 HydrophobicContact CD2-CB 3.85Å; F160-A182 HydrophobicContact CE2-CB 3.71Å; A178-A182 WeakPolarHBondContact O-CB 3.27Å; A178-A182 PolarHBondContact O-N 2.95Å; F179-A182 PolarHBondContact O-N 2.89Å; A182-S184 VanDerWaalsContact C-N 3.31Å; A182-S184 PolarHBondContact O-N 3.41Å; A182-V185 PolarHBondContact O-N 3.11Å; A182-L186 WeakPolarHBondContact O-CG 3.48Å; A182-L186 PolarHBondContact O-N 2.76Å; A182-L205 HydrophobicContact CB-CD2 3.71Å; A182-T209 HydrophobicContact CB-CG2 3.68Å
183	A	98.6	Very high	96.8	Very high	4 Å²	4	44.7 Å²	44.7	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-59.2	-42.3	175.8	0	0	0	0	0	111.6	T157 F160 F179 V185 L186 K187	T157-A183 HydrophobicContact CG2-CB 4.42Å; F160-A183 HydrophobicContact CB-CB 4.01Å; F160-A183 HydrophobicContact CD2-CB 4.23Å; F179-A183 WeakPolarHBondContact O-CB 3.35Å; F179-A183 PolarHBondContact O-N 3.04Å; A183-V185 VanDerWaalsContact C-N 3.33Å; A183-V185 PolarHBondContact O-N 2.95Å; A183-L186 PolarHBondContact O-N 2.68Å; A183-K187 WeakPolarHBondContact O-CB 3.41Å; A183-K187 VanDerWaalsContact O-CG 3.26Å; A183-K187 WeakPolarHBondContact O-CG 3.47Å; A183-K187 PolarHBondContact O-N 2.99Å
184	S	98.4	Very high	96.9	Very high	12 Å²	12	46.8 Å²	46.8	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-34.7	177.9	-178	0	0	0	0	113.5	R145 R180 R181 A182	R145-S184 PolarHBondContact NH2-OG 2.97Å; R180-S184 VanDerWaalsContact O-CB 3.3Å; R180-S184 WeakPolarHBondContact O-CB 3.26Å; R180-S184 PolarHBondContact O-N 2.66Å; R181-S184 WeakPolarHBondContact O-CB 3.36Å; R181-S184 PolarHBondContact O-N 3.08Å; A182-S184 VanDerWaalsContact C-N 3.31Å; A182-S184 PolarHBondContact O-N 3.41Å
185	V	98.3	Very high	96.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.5	-49.2	173.8	169.7	0	0	0	0	110	V138 R181 A182 A183 K187 S188 L202 P203 C204	V138-V185 HydrophobicContact CG1-CG1 4.15Å; R181-V185 PolarHBondContact O-N 2.86Å; A182-V185 PolarHBondContact O-N 3.11Å; A183-V185 VanDerWaalsContact C-N 3.33Å; A183-V185 PolarHBondContact O-N 2.95Å; V185-K187 VanDerWaalsContact C-N 3.33Å; V185-K187 PolarHBondContact O-N 2.88Å; V185-S188 PolarHBondContact O-N 3.18Å; V185-S188 PolarHBondContact O-OG 3.36Å; V185-L202 HydrophobicContact CG1-CB 4.28Å; V185-L202 HydrophobicContact CG1-CD1 4.49Å; V185-P203 HydrophobicContact CG2-CG 4.15Å; V185-C204 HydrophobicContact CG2-CB 4.14Å
186	L	98.3	Very high	96.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.4	-36.1	-178.7	-65	-175.1	0	0	0	113.3	N153 F156 T157 F160 A182 A183 S188 L189 V193 L202 L205 M213	N153-L186 HydrophobicContact CB-CB 4.03Å; N153-L186 PolarHBondContact ND2-O 3Å; F156-L186 HydrophobicContact CB-CD1 3.64Å; F156-L186 HydrophobicContact CD2-CD1 4.45Å; F156-L186 HydrophobicContact CG-CD1 4.27Å; T157-L186 HydrophobicContact CG2-CB 3.9Å; F160-L186 HydrophobicContact CD2-CD1 4.22Å; F160-L186 HydrophobicContact CE2-CD1 3.61Å; F160-L186 HydrophobicContact CZ-CD1 4.42Å; A182-L186 WeakPolarHBondContact O-CG 3.48Å; A182-L186 PolarHBondContact O-N 2.76Å; A183-L186 PolarHBondContact O-N 2.68Å; L186-S188 PolarHBondContact O-N 2.83Å; L186-L189 HydrophobicContact CD2-CD1 3.8Å; L186-L189 PolarHBondContact O-N 3.46Å; L186-V193 HydrophobicContact CD2-CG2 4.12Å; L186-L202 HydrophobicContact CD2-CD1 4.28Å; L186-L205 HydrophobicContact CD2-CD1 4.3Å; L186-L205 HydrophobicContact CG-CD2 4.49Å; L186-M213 HydrophobicContact CD1-CE 4Å; L186-M213 HydrophobicContact CD1-SD 4.07Å; L186-M213 HydrophobicContact CD2-CE 4.17Å
187	K	98.4	Very high	96.5	Very high	60 Å²	60	44.9 Å²	44.9	26%	0.261	24%	0.242	S	C	.	.	H	α-helix	trans	-60.8	-26.3	173.6	-76.1	176.5	-178.7	-176.7	0	113.4	T147 T157 E161 A183 V185	T147-K187 HydrophobicContact CG2-CB 3.84Å; T157-K187 HydrophobicContact CG2-CG 3.73Å; E161-K187 WeakPolarHBondContact OE1-CE 3.45Å; E161-K187 IonicContact OE1-NZ 3.52Å; E161-K187 PolarHBondContact OE1-NZ 3.39Å; A183-K187 WeakPolarHBondContact O-CB 3.41Å; A183-K187 VanDerWaalsContact O-CG 3.26Å; A183-K187 WeakPolarHBondContact O-CG 3.47Å; A183-K187 PolarHBondContact O-N 2.99Å; V185-K187 VanDerWaalsContact C-N 3.33Å; V185-K187 PolarHBondContact O-N 2.88Å
188	S	97.7	Very high	96.2	Very high	19 Å²	19	45.2 Å²	45.2	13%	0.133	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-8	-178.3	73	0	0	0	0	113.9	R145 T147 V185 L186	R145-S188 WeakPolarHBondContact CD-OG 3.41Å; T147-S188 WeakPolarHBondContact OG1-CB 3.26Å; V185-S188 PolarHBondContact O-N 3.18Å; V185-S188 PolarHBondContact O-OG 3.36Å; L186-S188 PolarHBondContact O-N 2.83Å
189	L	96.6	Very high	96	Very high	7 Å²	7	43 Å²	43	4%	0.037	23%	0.233	C	C	.	.			trans	-77.8	130.2	-176.6	-58.2	177.9	0	0	0	110.6	V138 N152 L186 W191 V193 L202	V138-L189 HydrophobicContact CG2-CD2 4.37Å; N152-L189 PolarHBondContact ND2-O 3.14Å; L186-L189 HydrophobicContact CD2-CD1 3.8Å; L186-L189 PolarHBondContact O-N 3.46Å; L189-W191 HydrophobicContact CB-CD2 4.49Å; L189-W191 HydrophobicContact CD1-CH2 3.97Å; L189-W191 HydrophobicContact CD1-CZ2 3.97Å; L189-W191 HydrophobicContact CD1-CZ3 4.33Å; L189-W191 HydrophobicContact CD2-CZ2 4.11Å; L189-W191 PolarHBondContact O-N 3.15Å; L189-W191 VanDerWaalsContact O-N 3.15Å; L189-V193 HydrophobicContact CD1-CG2 3.88Å; L189-L202 HydrophobicContact CD1-CD1 3.73Å; L189-L202 HydrophobicContact CD2-CD1 4.24Å; L189-L202 HydrophobicContact CD2-CD2 3.96Å
190	P	95.3	Very high	95.5	Very high	113 Å²	113	49.9 Å²	49.9	73%	0.734	27%	0.265	S	S	*	.	S	Bend	trans	-77.7	8.1	176.5	32.9	-34.1	0	0	0	112.8	N152	N152-P190 VanDerWaalsContact ND2-C 3.32Å; N152-P190 PolarHBondContact ND2-O 3.13Å
191	W	95	Very high	95.2	Very high	103 Å²	103	52.9 Å²	52.9	39%	0.39	29%	0.287	S	S	.	.	S	Bend	trans	-140.1	155.4	-177.5	51	-97	0	0	0	110.9	N153 L189 V193 A198 L202	N153-W191 PolarHBondContact ND2-O 2.68Å; L189-W191 HydrophobicContact CB-CD2 4.49Å; L189-W191 HydrophobicContact CD1-CH2 3.97Å; L189-W191 HydrophobicContact CD1-CZ2 3.97Å; L189-W191 HydrophobicContact CD1-CZ3 4.33Å; L189-W191 HydrophobicContact CD2-CZ2 4.11Å; L189-W191 PolarHBondContact O-N 3.15Å; L189-W191 VanDerWaalsContact O-N 3.15Å; W191-V193 HydrophobicContact CE3-CG2 4.2Å; W191-V193 HydrophobicContact CH2-CG2 4.05Å; W191-V193 HydrophobicContact CZ3-CB 4.1Å; W191-V193 HydrophobicContact CZ3-CG2 3.48Å; W191-V193 VanDerWaalsContact CZ3-CG2 3.48Å; W191-A198 HydrophobicContact CH2-CB 4.29Å; W191-A198 HydrophobicContact CZ3-CB 4.22Å; W191-L202 HydrophobicContact CH2-CD1 4.47Å
192	A	96.4	Very high	95	Very high	32 Å²	32	51 Å²	51	26%	0.264	28%	0.281	S	S	.	.			trans	-85	129.4	177.1	0	0	0	0	0	110.9	N152 R194	N152-A192 HydrophobicContact CB-CB 4.31Å; N152-A192 WeakPolarHBondContact O-CB 3.49Å; A192-R194 PolarHBondContact O-N 3.07Å
193	V	95.4	Very high	94.9	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.036	29%	0.29	C	S	.	.			trans	-69.5	122.7	176.6	178	0	0	0	0	110	N153 F156 L186 L189 W191 S195 T199 M213	N153-V193 WeakPolarHBondContact OD1-CG2 3.44Å; N153-V193 PolarHBondContact OD1-N 2.9Å; F156-V193 HydrophobicContact CD2-CB 4.47Å; F156-V193 HydrophobicContact CE2-CB 3.83Å; F156-V193 HydrophobicContact CE2-CG1 4.34Å; L186-V193 HydrophobicContact CD2-CG2 4.12Å; L189-V193 HydrophobicContact CD1-CG2 3.88Å; W191-V193 HydrophobicContact CE3-CG2 4.2Å; W191-V193 HydrophobicContact CH2-CG2 4.05Å; W191-V193 HydrophobicContact CZ3-CB 4.1Å; W191-V193 HydrophobicContact CZ3-CG2 3.48Å; W191-V193 VanDerWaalsContact CZ3-CG2 3.48Å; V193-S195 WeakPolarHBondContact CG1-O 3.32Å; V193-T199 HydrophobicContact CB-CG2 4.49Å; V193-T199 HydrophobicContact CG1-CG2 3.58Å; V193-T199 HydrophobicContact CG2-CG2 4Å; V193-M213 HydrophobicContact CB-CE 4.35Å; V193-M213 HydrophobicContact CG1-CE 3.81Å; V193-M213 HydrophobicContact CG2-CE 4.37Å
194	R	92.9	Very high	94.8	Very high	208 Å²	208	54.1 Å²	54.1	79%	0.785	30%	0.301	S	S	*	.			trans	-108.4	-16.9	179.8	-57.9	-58.7	-174.8	169.1	0.3	114	A192	A192-R194 PolarHBondContact O-N 3.07Å
195	S	93.6	Very high	94.8	Very high	60 Å²	60	54.2 Å²	54.2	42%	0.42	30%	0.301	S	S	.	.			trans	-149.5	152.9	177.4	72.8	0	0	0	0	110.1	V193 G197 A198	V193-S195 WeakPolarHBondContact CG1-O 3.32Å; S195-G197 PolarHBondContact O-N 3.34Å; S195-A198 WeakPolarHBondContact O-CB 3.26Å; S195-A198 PolarHBondContact O-N 3.49Å; S195-A198 PolarHBondContact OG-N 3.11Å
196	V	93.1	Very high	94.6	Very high	39 Å²	39	56.2 Å²	56.2	24%	0.236	32%	0.322	C	S	.	.	S	Bend	trans	-65	-32.1	175.8	-179.4	0	0	0	0	110.9	A198 T199 K210 M213 K214 L217	V196-A198 VanDerWaalsContact C-N 3.26Å; V196-A198 PolarHBondContact O-N 3.36Å; V196-T199 WeakPolarHBondContact O-CB 3.45Å; V196-T199 PolarHBondContact O-N 2.99Å; V196-T199 PolarHBondContact O-OG1 3.25Å; V196-K210 HydrophobicContact CG1-CB 4.11Å; V196-K210 HydrophobicContact CG1-CD 4.37Å; V196-K210 HydrophobicContact CG1-CG 4.18Å; V196-M213 HydrophobicContact CG2-CB 4.5Å; V196-K214 HydrophobicContact CG2-CB 3.9Å; V196-K214 HydrophobicContact CG2-CG 4.45Å; V196-L217 HydrophobicContact CG2-CD1 3.94Å
197	G	91.3	Very high	94.5	Very high	53 Å²	53	63.6 Å²	63.6	55%	0.546	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-57.8	-36.8	176.1	0	0	0	0	0	113.2	S195 T199 Q200	S195-G197 PolarHBondContact O-N 3.34Å; G197-T199 PolarHBondContact O-N 2.78Å; G197-Q200 WeakPolarHBondContact O-CB 3.31Å; G197-Q200 PolarHBondContact O-N 3.44Å
198	A	89.8	Confident	94.4	Very high	51 Å²	51	64 Å²	64	42%	0.421	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-62.8	-10.3	176.2	0	0	0	0	0	113.9	W191 S195 V196	W191-A198 HydrophobicContact CH2-CB 4.29Å; W191-A198 HydrophobicContact CZ3-CB 4.22Å; S195-A198 WeakPolarHBondContact O-CB 3.26Å; S195-A198 PolarHBondContact O-N 3.49Å; S195-A198 PolarHBondContact OG-N 3.11Å; V196-A198 VanDerWaalsContact C-N 3.26Å; V196-A198 PolarHBondContact O-N 3.36Å
199	T	93	Very high	94.4	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-105.8	6.5	-178.2	72.3	0	0	0	0	114.2	V193 V196 G197 D201 L202 L205 M213	V193-T199 HydrophobicContact CB-CG2 4.49Å; V193-T199 HydrophobicContact CG1-CG2 3.58Å; V193-T199 HydrophobicContact CG2-CG2 4Å; V196-T199 WeakPolarHBondContact O-CB 3.45Å; V196-T199 PolarHBondContact O-N 2.99Å; V196-T199 PolarHBondContact O-OG1 3.25Å; G197-T199 PolarHBondContact O-N 2.78Å; T199-D201 VanDerWaalsContact C-N 3.28Å; T199-D201 PolarHBondContact O-N 2.89Å; T199-L202 HydrophobicContact CG2-CD1 4.04Å; T199-L202 WeakPolarHBondContact O-CB 3.3Å; T199-L202 PolarHBondContact O-N 3.08Å; T199-L202 VanDerWaalsContact O-N 3.09Å; T199-L205 HydrophobicContact CG2-CD1 4.15Å; T199-M213 HydrophobicContact CG2-CE 3.81Å
200	Q	89.2	Confident	94.5	Very high	149 Å²	149	65.7 Å²	65.7	70%	0.696	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-41.3	-173.5	-179.3	171.1	-3.5	0	0	113.3	G197	G197-Q200 WeakPolarHBondContact O-CB 3.31Å; G197-Q200 PolarHBondContact O-N 3.44Å
201	D	90.3	Very high	94.6	Very high	135 Å²	135	62.7 Å²	62.7	72%	0.722	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	0.2	-177.6	-61.8	-43.4	0	0	0	114	T199	T199-D201 VanDerWaalsContact C-N 3.28Å; T199-D201 PolarHBondContact O-N 2.89Å
202	L	95.5	Very high	94.8	Very high	20 Å²	20	58 Å²	58	11%	0.105	33%	0.331	C	S	.	.			trans	-79.1	131.6	-179.6	-64.3	-176.4	0	0	0	110.6	V138 V185 L186 L189 W191 T199 L205	V138-L202 HydrophobicContact CB-CD2 3.94Å; V138-L202 HydrophobicContact CG1-CD2 4.36Å; V138-L202 HydrophobicContact CG2-CD2 3.7Å; V185-L202 HydrophobicContact CG1-CB 4.28Å; V185-L202 HydrophobicContact CG1-CD1 4.49Å; L186-L202 HydrophobicContact CD2-CD1 4.28Å; L189-L202 HydrophobicContact CD1-CD1 3.73Å; L189-L202 HydrophobicContact CD2-CD1 4.24Å; L189-L202 HydrophobicContact CD2-CD2 3.96Å; W191-L202 HydrophobicContact CH2-CD1 4.47Å; T199-L202 HydrophobicContact CG2-CD1 4.04Å; T199-L202 WeakPolarHBondContact O-CB 3.3Å; T199-L202 PolarHBondContact O-N 3.08Å; T199-L202 VanDerWaalsContact O-N 3.09Å; L202-L205 HydrophobicContact CB-CD1 3.75Å; L202-L205 HydrophobicContact CB-CG 4.37Å; L202-L205 HydrophobicContact CD1-CD1 3.99Å; L202-L205 HydrophobicContact CG-CD1 4.5Å
203	P	96.5	Very high	94.8	Very high	29 Å²	29	56.4 Å²	56.4	19%	0.188	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	165.4	176.5	33.8	-37.9	0	0	0	110.8	V138 Q140 V185 L205	V138-P203 HydrophobicContact CG1-CG 4.42Å; V138-P203 WeakPolarHBondContact O-CD 3.5Å; V138-P203 VanDerWaalsContact O-CG 3.29Å; V138-P203 WeakPolarHBondContact O-CG 3.45Å; Q140-P203 HydrophobicContact CB-CB 3.88Å; Q140-P203 HydrophobicContact CB-CG 4.29Å; V185-P203 HydrophobicContact CG2-CG 4.15Å; P203-L205 PolarHBondContact O-N 2.75Å
204	C	96.8	Very high	94.9	Very high	40 Å²	40	62.4 Å²	62.4	27%	0.27	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	7.7	172.3	-50.5	0	0	0	0	115.8	R181 V185	R181-C204 HydrophobicContact CB-CB 3.8Å; V185-C204 HydrophobicContact CG2-CB 4.14Å
205	L	96.9	Very high	95.2	Very high	15 Å²	15	54.9 Å²	54.9	8%	0.079	32%	0.318	C	S	.	.			trans	-99.4	95.6	171.3	-60.3	-178.4	0	0	0	109.9	F160 A182 L186 T199 L202 P203 T209 K210 M213	F160-L205 HydrophobicContact CE2-CD2 4.5Å; A182-L205 HydrophobicContact CB-CD2 3.71Å; L186-L205 HydrophobicContact CD2-CD1 4.3Å; L186-L205 HydrophobicContact CG-CD2 4.49Å; T199-L205 HydrophobicContact CG2-CD1 4.15Å; L202-L205 HydrophobicContact CB-CD1 3.75Å; L202-L205 HydrophobicContact CB-CG 4.37Å; L202-L205 HydrophobicContact CD1-CD1 3.99Å; L202-L205 HydrophobicContact CG-CD1 4.5Å; P203-L205 PolarHBondContact O-N 2.75Å; L205-T209 WeakPolarHBondContact CA-OG1 3.33Å; L205-K210 HydrophobicContact CB-CG 4.37Å; L205-K210 WeakPolarHBondContact O-CE 3.24Å; L205-M213 HydrophobicContact CD1-SD 4.39Å; L205-M213 HydrophobicContact CD2-SD 4.3Å
206	G	94.9	Very high	95.4	Very high	42 Å²	42	52.2 Å²	52.2	43%	0.433	30%	0.299	S	S	.	.			trans	-83.1	179.4	173.2	0	0	0	0	0	113	H208 T209 K210	G206-H208 PolarHBondContact O-N 3.43Å; G206-T209 PolarHBondContact N-OG1 3.18Å; G206-T209 PolarHBondContact O-N 3.21Å; G206-T209 PolarHBondContact O-OG1 2.58Å; G206-K210 WeakPolarHBondContact O-CG 3.43Å; G206-K210 PolarHBondContact O-N 3.05Å
207	E	95.9	Very high	95.5	Very high	155 Å²	155	53.5 Å²	53.5	72%	0.724	30%	0.304	S	S	*	.	H	α-helix	trans	-56.7	-46.8	-176.8	-168.5	57.3	-150.9	0	0	112.5	T209 K210 A211	E207-T209 PolarHBondContact O-N 3.29Å; E207-K210 PolarHBondContact O-N 2.88Å; E207-A211 WeakPolarHBondContact O-CB 3.4Å; E207-A211 PolarHBondContact O-N 3.38Å
208	H	97.3	Very high	95.7	Very high	68 Å²	68	56.6 Å²	56.6	32%	0.315	30%	0.304	S	S	.	.	H	α-helix	trans	-63.8	-44.8	-179.9	-166.4	177.2	0	0	0	112.1	Y167 F179 G206 K210 A211 V212 E224	Y167-H208 PolarHBondContact OH-CE1 3.36Å; F179-H208 AromaticContact CZ-ND1 3.94Å; G206-H208 PolarHBondContact O-N 3.43Å; H208-K210 VanDerWaalsContact C-N 3.3Å; H208-K210 PolarHBondContact O-N 3.44Å; H208-A211 PolarHBondContact O-N 2.89Å; H208-V212 WeakPolarHBondContact O-CG2 3.43Å; H208-V212 PolarHBondContact O-N 3.13Å; H208-E224 IonicContact CD2-OE2 3.46Å; H208-E224 IonicContact CE1-OE1 2.93Å; H208-E224 IonicContact CE1-OE2 3.98Å; H208-E224 IonicContact NE2-OE1 2.76Å; H208-E224 IonicContact NE2-OE2 2.88Å; H208-E224 PolarHBondContact NE2-OE2 3Å
209	T	97.4	Very high	95.9	Very high	7 Å²	7	60 Å²	60	4%	0.043	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-39.1	175.8	46	0	0	0	0	111.9	F160 F179 A182 L205 G206 E207 V212 M213	F160-T209 HydrophobicContact CE1-CG2 4.32Å; F160-T209 HydrophobicContact CE2-CG2 4.31Å; F160-T209 HydrophobicContact CZ-CG2 4.01Å; F179-T209 HydrophobicContact CD1-CG2 3.67Å; F179-T209 HydrophobicContact CE1-CG2 3.56Å; F179-T209 HydrophobicContact CG-CG2 4.47Å; F179-T209 HydrophobicContact CZ-CG2 4.28Å; A182-T209 HydrophobicContact CB-CG2 3.68Å; L205-T209 WeakPolarHBondContact CA-OG1 3.33Å; G206-T209 PolarHBondContact N-OG1 3.18Å; G206-T209 PolarHBondContact O-N 3.21Å; G206-T209 PolarHBondContact O-OG1 2.58Å; E207-T209 PolarHBondContact O-N 3.29Å; T209-V212 PolarHBondContact O-N 3.14Å; T209-M213 VanDerWaalsContact O-CG 3.24Å; T209-M213 WeakPolarHBondContact O-CG 3.16Å; T209-M213 PolarHBondContact O-N 2.93Å
210	K	97.8	Very high	95.9	Very high	55 Å²	55	62.4 Å²	62.4	24%	0.239	33%	0.332	C	S	.	.	H	α-helix	trans	-68.4	-37.3	177.1	-73	178.7	178.8	177.7	0	112.1	V196 L205 G206 E207 H208 M213 K214	V196-K210 HydrophobicContact CG1-CB 4.11Å; V196-K210 HydrophobicContact CG1-CD 4.37Å; V196-K210 HydrophobicContact CG1-CG 4.18Å; L205-K210 HydrophobicContact CB-CG 4.37Å; L205-K210 WeakPolarHBondContact O-CE 3.24Å; G206-K210 WeakPolarHBondContact O-CG 3.43Å; G206-K210 PolarHBondContact O-N 3.05Å; E207-K210 PolarHBondContact O-N 2.88Å; H208-K210 VanDerWaalsContact C-N 3.3Å; H208-K210 PolarHBondContact O-N 3.44Å; K210-M213 PolarHBondContact O-N 3.19Å; K210-K214 WeakPolarHBondContact O-CB 3.44Å; K210-K214 PolarHBondContact O-N 2.97Å
211	A	97.8	Very high	96.1	Very high	49 Å²	49	60.8 Å²	60.8	41%	0.405	32%	0.319	S	S	.	.	H	α-helix	trans	-61.7	-46.8	174.3	0	0	0	0	0	111.5	E207 H208 M213 K214 E215	E207-A211 WeakPolarHBondContact O-CB 3.4Å; E207-A211 PolarHBondContact O-N 3.38Å; H208-A211 PolarHBondContact O-N 2.89Å; A211-M213 PolarHBondContact O-N 3.1Å; A211-K214 WeakPolarHBondContact O-CB 3.15Å; A211-K214 PolarHBondContact O-N 3.01Å; A211-E215 PolarHBondContact O-N 3.28Å
212	V	98.1	Very high	96.4	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.024	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-42.5	175.3	173.4	0	0	0	0	111.1	F160 L163 H208 T209 K214 E215 I216	F160-V212 HydrophobicContact CD1-CG1 4.22Å; F160-V212 HydrophobicContact CE1-CB 4.03Å; F160-V212 HydrophobicContact CE1-CG1 3.77Å; L163-V212 HydrophobicContact CD1-CG1 4.14Å; L163-V212 HydrophobicContact CD1-CG2 4.03Å; H208-V212 WeakPolarHBondContact O-CG2 3.43Å; H208-V212 PolarHBondContact O-N 3.13Å; T209-V212 PolarHBondContact O-N 3.14Å; V212-K214 PolarHBondContact O-N 3.29Å; V212-E215 PolarHBondContact O-N 3.01Å; V212-I216 HydrophobicContact CG1-CD1 3.78Å; V212-I216 WeakPolarHBondContact O-CG1 3.29Å; V212-I216 PolarHBondContact O-N 2.94Å
213	M	98.3	Very high	96.4	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-41.4	175.8	-69.4	175	72.3	0	0	112.4	F156 F160 L186 V193 V196 T199 L205 T209 K210 A211 E215 I216 L217	F156-M213 HydrophobicContact CD1-CB 4.03Å; F156-M213 HydrophobicContact CD1-CE 4.38Å; F156-M213 HydrophobicContact CD1-CG 3.69Å; F156-M213 HydrophobicContact CD2-CE 4.32Å; F156-M213 HydrophobicContact CE1-CB 4Å; F156-M213 HydrophobicContact CE1-CE 4.5Å; F156-M213 HydrophobicContact CE1-CG 4.14Å; F156-M213 HydrophobicContact CE2-CE 4.46Å; F156-M213 HydrophobicContact CG-CE 4.29Å; F156-M213 HydrophobicContact CG-CG 4.2Å; F160-M213 HydrophobicContact CE1-CG 4.3Å; F160-M213 HydrophobicContact CE2-CG 4.49Å; F160-M213 HydrophobicContact CE2-SD 4.4Å; F160-M213 HydrophobicContact CZ-CG 3.63Å; F160-M213 HydrophobicContact CZ-SD 3.97Å; L186-M213 HydrophobicContact CD1-CE 4Å; L186-M213 HydrophobicContact CD1-SD 4.07Å; L186-M213 HydrophobicContact CD2-CE 4.17Å; V193-M213 HydrophobicContact CB-CE 4.35Å; V193-M213 HydrophobicContact CG1-CE 3.81Å; V193-M213 HydrophobicContact CG2-CE 4.37Å; V196-M213 HydrophobicContact CG2-CB 4.5Å; T199-M213 HydrophobicContact CG2-CE 3.81Å; L205-M213 HydrophobicContact CD1-SD 4.39Å; L205-M213 HydrophobicContact CD2-SD 4.3Å; T209-M213 VanDerWaalsContact O-CG 3.24Å; T209-M213 WeakPolarHBondContact O-CG 3.16Å; T209-M213 PolarHBondContact O-N 2.93Å; K210-M213 PolarHBondContact O-N 3.19Å; A211-M213 PolarHBondContact O-N 3.1Å; M213-E215 VanDerWaalsContact C-N 3.33Å; M213-I216 PolarHBondContact O-N 2.65Å; M213-L217 WeakPolarHBondContact O-CB 3.13Å; M213-L217 VanDerWaalsContact O-CG 3.28Å; M213-L217 WeakPolarHBondContact O-CG 3.36Å; M213-L217 PolarHBondContact O-N 3.37Å
214	K	97.7	Very high	96.4	Very high	132 Å²	132	59.3 Å²	59.3	57%	0.574	30%	0.304	S	S	*	.	H	α-helix	trans	-60.1	-45.6	176.4	-172.1	179.7	175.3	-178.1	0	111	V196 K210 A211 V212 L217 Q218	V196-K214 HydrophobicContact CG2-CB 3.9Å; V196-K214 HydrophobicContact CG2-CG 4.45Å; K210-K214 WeakPolarHBondContact O-CB 3.44Å; K210-K214 PolarHBondContact O-N 2.97Å; A211-K214 WeakPolarHBondContact O-CB 3.15Å; A211-K214 PolarHBondContact O-N 3.01Å; V212-K214 PolarHBondContact O-N 3.29Å; K214-L217 PolarHBondContact O-N 2.95Å; K214-Q218 WeakPolarHBondContact O-CB 3.47Å; K214-Q218 PolarHBondContact O-N 2.81Å
215	E	97.4	Very high	96.4	Very high	49 Å²	49	58 Å²	58	23%	0.229	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-47.8	177.4	-171.5	177.2	-107.8	0	0	111.3	A211 V212 M213 L217 Q218 Y219 R221 S222 F223	A211-E215 PolarHBondContact O-N 3.28Å; V212-E215 PolarHBondContact O-N 3.01Å; M213-E215 VanDerWaalsContact C-N 3.33Å; E215-L217 PolarHBondContact O-N 3.29Å; E215-Q218 PolarHBondContact O-N 3.31Å; E215-Y219 HydrophobicContact CG-CD2 3.8Å; E215-Y219 HydrophobicContact CG-CE2 4.25Å; E215-Y219 VanDerWaalsContact O-CD2 3.32Å; E215-Y219 WeakPolarHBondContact O-CD2 2.96Å; E215-Y219 PolarHBondContact O-N 3.49Å; E215-R221 CarbonylContact C-O 3.49Å; E215-S222 WeakPolarHBondContact OE2-CA 3.21Å; E215-S222 VanDerWaalsContact OE2-CB 3.27Å; E215-S222 WeakPolarHBondContact OE2-CB 3.48Å; E215-S222 PolarHBondContact OE2-OG 2.83Å; E215-F223 HydrophobicContact CG-CD2 4.02Å; E215-F223 HydrophobicContact CG-CE2 4.4Å; E215-F223 WeakPolarHBondContact OE1-CD2 3.48Å; E215-F223 PolarHBondContact OE2-N 3.4Å
216	I	97.8	Very high	96.5	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-41.4	177.3	-70.6	167.3	0	0	0	111.8	I155 F156 A159 V212 M213 Q218 G220 R221	I155-I216 HydrophobicContact CB-CG2 4.35Å; I155-I216 HydrophobicContact CD1-CG2 3.51Å; I155-I216 HydrophobicContact CG1-CG2 3.54Å; I155-I216 HydrophobicContact CG2-CG2 4.08Å; F156-I216 HydrophobicContact CD1-CB 4.06Å; F156-I216 HydrophobicContact CD1-CD1 3.98Å; F156-I216 HydrophobicContact CD1-CG2 3.8Å; F156-I216 HydrophobicContact CE1-CB 3.82Å; F156-I216 HydrophobicContact CE1-CG2 3.52Å; F156-I216 HydrophobicContact CZ-CG2 4.37Å; A159-I216 HydrophobicContact CB-CD1 3.62Å; V212-I216 HydrophobicContact CG1-CD1 3.78Å; V212-I216 WeakPolarHBondContact O-CG1 3.29Å; V212-I216 PolarHBondContact O-N 2.94Å; M213-I216 PolarHBondContact O-N 2.65Å; I216-Q218 VanDerWaalsContact C-N 3.31Å; I216-Q218 PolarHBondContact O-N 2.81Å; I216-G220 WeakPolarHBondContact O-CA 3.26Å; I216-G220 PolarHBondContact O-N 3.13Å; I216-R221 WeakPolarHBondContact CA-O 3.44Å; I216-R221 PolarHBondContact N-O 3.42Å
217	L	95.3	Very high	96.6	Very high	65 Å²	65	66.5 Å²	66.5	34%	0.34	32%	0.32	S	S	.	.	H	α-helix	trans	-65.5	-35.4	176.8	-76.4	167.4	0	0	0	112.3	F156 V196 M213 K214 E215	F156-L217 HydrophobicContact CE1-CD2 4.42Å; F156-L217 HydrophobicContact CE1-CG 3.98Å; F156-L217 HydrophobicContact CZ-CD1 4.34Å; F156-L217 HydrophobicContact CZ-CD2 3.72Å; F156-L217 HydrophobicContact CZ-CG 3.74Å; V196-L217 HydrophobicContact CG2-CD1 3.94Å; M213-L217 WeakPolarHBondContact O-CB 3.13Å; M213-L217 VanDerWaalsContact O-CG 3.28Å; M213-L217 WeakPolarHBondContact O-CG 3.36Å; M213-L217 PolarHBondContact O-N 3.37Å; K214-L217 PolarHBondContact O-N 2.95Å; E215-L217 PolarHBondContact O-N 3.29Å
218	Q	96	Very high	96.6	Very high	119 Å²	119	59.8 Å²	59.8	56%	0.556	29%	0.289	S	S	*	.	H	α-helix	trans	-79.8	-41	-177.5	-174.6	175	-1.1	0	0	112.7	K214 E215 I216	K214-Q218 WeakPolarHBondContact O-CB 3.47Å; K214-Q218 PolarHBondContact O-N 2.81Å; E215-Q218 PolarHBondContact O-N 3.31Å; I216-Q218 VanDerWaalsContact C-N 3.31Å; I216-Q218 PolarHBondContact O-N 2.81Å
219	Y	94.4	Very high	96.5	Very high	122 Å²	122	60.4 Å²	60.4	48%	0.478	30%	0.295	S	S	.	.	H	α-helix	trans	-116.1	-4.8	-170	-54.2	-66.7	0	0	0	113.9	E215 R221 F223	E215-Y219 HydrophobicContact CG-CD2 3.8Å; E215-Y219 HydrophobicContact CG-CE2 4.25Å; E215-Y219 VanDerWaalsContact O-CD2 3.32Å; E215-Y219 WeakPolarHBondContact O-CD2 2.96Å; E215-Y219 PolarHBondContact O-N 3.49Å; Y219-R221 PolarHBondContact O-N 2.82Å; Y219-F223 AromaticContact CD2-CE2 3.77Å; Y219-F223 HydrophobicContact CD2-CE2 3.77Å; Y219-F223 HydrophobicContact CE2-CE2 4.1Å; Y219-F223 HydrophobicContact CG-CE2 4.11Å; Y219-F223 HydrophobicContact CG-CZ 4.44Å
220	G	92.7	Very high	96.4	Very high	50 Å²	50	64.3 Å²	64.3	52%	0.515	32%	0.322	S	S	.	.	S	Bend	trans	76.3	1.8	-175	0	0	0	0	0	114.5	I216	I216-G220 WeakPolarHBondContact O-CA 3.26Å; I216-G220 PolarHBondContact O-N 3.13Å
221	R	92.6	Very high	96.3	Very high	116 Å²	116	65 Å²	65	44%	0.438	33%	0.328	S	S	.	.	S	Bend	trans	-155.2	166.6	-173.9	54.8	167.9	172.6	-176.5	2.6	111.6	E215 I216 Y219 E226	E215-R221 CarbonylContact C-O 3.49Å; I216-R221 WeakPolarHBondContact CA-O 3.44Å; I216-R221 PolarHBondContact N-O 3.42Å; Y219-R221 PolarHBondContact O-N 2.82Å; R221-E226 VanDerWaalsContact CD-CD 3.42Å; R221-E226 WeakPolarHBondContact CD-OE1 3.38Å; R221-E226 IonicContact CZ-OE1 2.72Å; R221-E226 IonicContact CZ-OE2 3.4Å; R221-E226 IonicContact NE-OE1 2.69Å; R221-E226 IonicContact NE-OE2 3.78Å; R221-E226 VanDerWaalsContact NH1-CD 3.34Å; R221-E226 IonicContact NH1-OE1 2.76Å; R221-E226 PolarHBondContact NH1-OE1 3.5Å; R221-E226 IonicContact NH1-OE2 3.85Å; R221-E226 PolarHBondContact NH1-OE2 3.33Å
222	S	97.4	Very high	96.3	Very high	5 Å²	5	67.4 Å²	67.4	4%	0.035	33%	0.331	C	S	.	.			trans	-113.4	127.2	168.7	175.7	0	0	0	0	111.5	E215 V225 E226	E215-S222 WeakPolarHBondContact OE2-CA 3.21Å; E215-S222 VanDerWaalsContact OE2-CB 3.27Å; E215-S222 WeakPolarHBondContact OE2-CB 3.48Å; E215-S222 PolarHBondContact OE2-OG 2.83Å; S222-V225 PolarHBondContact O-N 2.95Å; S222-E226 PolarHBondContact O-N 3.42Å
223	F	95.6	Very high	96.2	Very high	88 Å²	88	70 Å²	70	39%	0.386	34%	0.341	S	S	.	.	H	α-helix	trans	-70.4	-34.3	-179.2	-64.9	-73.6	0	0	0	111.8	E215 Y219 V225 E226 K227	E215-F223 HydrophobicContact CG-CD2 4.02Å; E215-F223 HydrophobicContact CG-CE2 4.4Å; E215-F223 WeakPolarHBondContact OE1-CD2 3.48Å; E215-F223 PolarHBondContact OE2-N 3.4Å; Y219-F223 AromaticContact CD2-CE2 3.77Å; Y219-F223 HydrophobicContact CD2-CE2 3.77Å; Y219-F223 HydrophobicContact CE2-CE2 4.1Å; Y219-F223 HydrophobicContact CG-CE2 4.11Å; Y219-F223 HydrophobicContact CG-CZ 4.44Å; F223-V225 VanDerWaalsContact C-N 3.31Å; F223-V225 PolarHBondContact O-N 3.05Å; F223-E226 PolarHBondContact O-N 2.58Å; F223-K227 WeakPolarHBondContact O-CB 3.25Å; F223-K227 PolarHBondContact O-N 3.15Å
224	E	96.6	Very high	96	Very high	59 Å²	59	70.2 Å²	70.2	28%	0.276	34%	0.342	S	S	.	.	H	α-helix	trans	-60.1	-44	172.4	-174.4	-178.8	174.4	0	0	110.6	L163 H208 K227 I228	L163-E224 VanDerWaalsContact CD2-CD 3.49Å; L163-E224 HydrophobicContact CD2-CG 3.8Å; L163-E224 WeakPolarHBondContact CD2-OE1 3.38Å; H208-E224 IonicContact CD2-OE2 3.46Å; H208-E224 IonicContact CE1-OE1 2.93Å; H208-E224 IonicContact CE1-OE2 3.98Å; H208-E224 IonicContact NE2-OE1 2.76Å; H208-E224 IonicContact NE2-OE2 2.88Å; H208-E224 PolarHBondContact NE2-OE2 3Å; E224-K227 PolarHBondContact O-N 3.07Å; E224-I228 HydrophobicContact CG-CD1 4.19Å; E224-I228 WeakPolarHBondContact O-CG1 3.29Å; E224-I228 PolarHBondContact O-N 3.42Å
225	V	97.4	Very high	95.9	Very high	13 Å²	13	68.9 Å²	68.9	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-65.7	-46.8	178.2	174.8	0	0	0	0	111.4	A159 V162 L163 S222 F223 K227 I228 L229	A159-V225 HydrophobicContact CB-CG2 3.93Å; V162-V225 HydrophobicContact CB-CG1 4.09Å; V162-V225 HydrophobicContact CG1-CG1 3.98Å; V162-V225 HydrophobicContact CG2-CG1 4.3Å; L163-V225 HydrophobicContact CD1-CG2 4.07Å; L163-V225 HydrophobicContact CD2-CG2 4.28Å; L163-V225 HydrophobicContact CG-CG2 3.94Å; S222-V225 PolarHBondContact O-N 2.95Å; F223-V225 VanDerWaalsContact C-N 3.31Å; F223-V225 PolarHBondContact O-N 3.05Å; V225-K227 VanDerWaalsContact C-N 3.29Å; V225-K227 PolarHBondContact O-N 2.93Å; V225-I228 PolarHBondContact O-N 3.36Å; V225-L229 HydrophobicContact CG1-CD1 3.92Å; V225-L229 HydrophobicContact CG1-CG 4.3Å; V225-L229 WeakPolarHBondContact O-CG 3.21Å; V225-L229 PolarHBondContact O-N 3.32Å
226	E	97.2	Very high	95.9	Very high	71 Å²	71	66.9 Å²	66.9	33%	0.332	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-40.7	177.1	-74.4	-173.8	156.1	0	0	112.2	R221 S222 F223 L229 S230	R221-E226 VanDerWaalsContact CD-CD 3.42Å; R221-E226 WeakPolarHBondContact CD-OE1 3.38Å; R221-E226 IonicContact CZ-OE1 2.72Å; R221-E226 IonicContact CZ-OE2 3.4Å; R221-E226 IonicContact NE-OE1 2.69Å; R221-E226 IonicContact NE-OE2 3.78Å; R221-E226 VanDerWaalsContact NH1-CD 3.34Å; R221-E226 IonicContact NH1-OE1 2.76Å; R221-E226 PolarHBondContact NH1-OE1 3.5Å; R221-E226 IonicContact NH1-OE2 3.85Å; R221-E226 PolarHBondContact NH1-OE2 3.33Å; S222-E226 PolarHBondContact O-N 3.42Å; F223-E226 PolarHBondContact O-N 2.58Å; E226-L229 PolarHBondContact O-N 3.05Å; E226-S230 WeakPolarHBondContact O-CB 3.14Å; E226-S230 PolarHBondContact O-N 2.97Å; E226-S230 PolarHBondContact O-OG 3.37Å
227	K	97.3	Very high	95.9	Very high	164 Å²	164	66.9 Å²	66.9	71%	0.713	33%	0.329	S	S	*	.	H	α-helix	trans	-60.8	-45.5	175.2	-176.8	-179.2	178	-178.7	0	111.5	F223 E224 V225 S230 D231	F223-K227 WeakPolarHBondContact O-CB 3.25Å; F223-K227 PolarHBondContact O-N 3.15Å; E224-K227 PolarHBondContact O-N 3.07Å; V225-K227 VanDerWaalsContact C-N 3.29Å; V225-K227 PolarHBondContact O-N 2.93Å; K227-S230 PolarHBondContact O-N 3.19Å; K227-D231 PolarHBondContact O-N 3.15Å; K227-D231 VanDerWaalsContact O-N 3.11Å
228	I	96.6	Very high	95.9	Very high	14 Å²	14	66.5 Å²	66.5	7%	0.072	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-43.7	177.3	-70.7	164.7	0	0	0	111	V162 L163 N166 E224 V225 S230 D231 C234	V162-I228 HydrophobicContact CG1-CB 4.3Å; V162-I228 HydrophobicContact CG1-CG2 3.73Å; L163-I228 HydrophobicContact CD2-CD1 3.58Å; N166-I228 HydrophobicContact CB-CD1 4.03Å; N166-I228 HydrophobicContact CB-CG1 4.49Å; N166-I228 HydrophobicContact CB-CG2 3.85Å; E224-I228 HydrophobicContact CG-CD1 4.19Å; E224-I228 WeakPolarHBondContact O-CG1 3.29Å; E224-I228 PolarHBondContact O-N 3.42Å; V225-I228 PolarHBondContact O-N 3.36Å; I228-S230 PolarHBondContact O-N 3.19Å; I228-D231 WeakPolarHBondContact O-CB 3.15Å; I228-D231 PolarHBondContact O-N 3.04Å; I228-D231 VanDerWaalsContact O-N 3.16Å; I228-C234 HydrophobicContact CG2-CB 4.44Å; I228-C234 WeakPolarHBondContact O-CB 3.34Å
229	L	95.3	Very high	96	Very high	82 Å²	82	63.6 Å²	63.6	43%	0.429	31%	0.312	S	S	.	.	H	α-helix	trans	-65.4	-25.6	179.1	-69.5	175.1	0	0	0	112.7	V162 V225 E226 Q235	V162-L229 HydrophobicContact CG1-CD2 3.94Å; V162-L229 HydrophobicContact CG1-CG 4.15Å; V162-L229 HydrophobicContact CG2-CD2 4.03Å; V225-L229 HydrophobicContact CG1-CD1 3.92Å; V225-L229 HydrophobicContact CG1-CG 4.3Å; V225-L229 WeakPolarHBondContact O-CG 3.21Å; V225-L229 PolarHBondContact O-N 3.32Å; E226-L229 PolarHBondContact O-N 3.05Å; L229-Q235 PolarHBondContact O-NE2 2.64Å
230	S	95.9	Very high	96.2	Very high	89 Å²	89	57.8 Å²	57.8	62%	0.622	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-4.2	177.7	-50.7	0	0	0	0	113.4	E226 K227 I228	E226-S230 WeakPolarHBondContact O-CB 3.14Å; E226-S230 PolarHBondContact O-N 2.97Å; E226-S230 PolarHBondContact O-OG 3.37Å; K227-S230 PolarHBondContact O-N 3.19Å; I228-S230 PolarHBondContact O-N 3.19Å
231	D	96	Very high	96.4	Very high	68 Å²	68	57.2 Å²	57.2	36%	0.364	28%	0.277	S	S	.	.			trans	-77.4	121.7	-178.5	177.1	73.1	0	0	0	110.9	K227 I228 R233 C234 Q235	K227-D231 PolarHBondContact O-N 3.15Å; K227-D231 VanDerWaalsContact O-N 3.11Å; I228-D231 WeakPolarHBondContact O-CB 3.15Å; I228-D231 PolarHBondContact O-N 3.04Å; I228-D231 VanDerWaalsContact O-N 3.16Å; D231-R233 VanDerWaalsContact C-N 3.26Å; D231-R233 PolarHBondContact O-N 3.01Å; D231-R233 VanDerWaalsContact OD2-CB 3.3Å; D231-R233 WeakPolarHBondContact OD2-CB 3.47Å; D231-R233 PolarHBondContact OD2-N 2.87Å; D231-C234 HydrophobicContact CB-CB 4.04Å; D231-C234 PolarHBondContact O-N 3.39Å; D231-C234 VanDerWaalsContact O-N 3.15Å; D231-C234 WeakPolarHBondContact OD2-CB 3.35Å; D231-C234 PolarHBondContact OD2-N 3.05Å; D231-Q235 WeakPolarHBondContact O-CG 3.37Å; D231-Q235 PolarHBondContact O-N 2.89Å
232	E	96.8	Very high	96.6	Very high	101 Å²	101	54.1 Å²	54.1	47%	0.472	27%	0.272	S	S	.	.	H	α-helix	trans	-57.3	-39.7	-177.3	-175.3	-164.7	179.3	0	0	111.9	Q235 T236 R260	E232-Q235 PolarHBondContact O-N 3.37Å; E232-T236 VanDerWaalsContact O-CB 3.32Å; E232-T236 WeakPolarHBondContact O-CB 3.43Å; E232-T236 PolarHBondContact O-N 2.65Å; E232-T236 PolarHBondContact O-OG1 2.89Å; E232-R260 WeakPolarHBondContact OE1-CD 3.42Å; E232-R260 IonicContact OE1-CZ 3.17Å; E232-R260 IonicContact OE1-NE 3.32Å; E232-R260 PolarHBondContact OE1-NE 3.34Å; E232-R260 IonicContact OE1-NH2 2.7Å
233	R	95.1	Very high	96.6	Very high	59 Å²	59	54 Å²	54	22%	0.223	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-51.6	177.4	174.7	-174.8	165.6	80.2	8.5	110	D231 Q235 T236 L237 E252 Y255	D231-R233 VanDerWaalsContact C-N 3.26Å; D231-R233 PolarHBondContact O-N 3.01Å; D231-R233 VanDerWaalsContact OD2-CB 3.3Å; D231-R233 WeakPolarHBondContact OD2-CB 3.47Å; D231-R233 PolarHBondContact OD2-N 2.87Å; R233-Q235 PolarHBondContact O-N 3.34Å; R233-T236 PolarHBondContact O-N 3.09Å; R233-L237 HydrophobicContact CG-CD1 3.98Å; R233-L237 HydrophobicContact CG-CG 4.37Å; R233-L237 WeakPolarHBondContact O-CB 3.39Å; R233-L237 VanDerWaalsContact O-CG 3.26Å; R233-L237 WeakPolarHBondContact O-CG 3.41Å; R233-L237 PolarHBondContact O-N 2.62Å; R233-E252 IonicContact CZ-OE1 2.69Å; R233-E252 IonicContact CZ-OE2 3.69Å; R233-E252 VanDerWaalsContact NH1-CD 3.26Å; R233-E252 IonicContact NH1-OE1 3.55Å; R233-E252 PolarHBondContact NH1-OE1 2.75Å; R233-E252 IonicContact NH1-OE2 3.73Å; R233-E252 PolarHBondContact NH1-OE2 2.88Å; R233-E252 VanDerWaalsContact NH2-CD 3.32Å; R233-E252 IonicContact NH2-OE1 3.8Å; R233-E252 PolarHBondContact NH2-OE1 3.08Å; R233-E252 IonicContact NH2-OE2 3.18Å; R233-E252 PolarHBondContact NH2-OE2 3.36Å; R233-Y255 HydrophobicContact CB-CE1 3.98Å; R233-Y255 HydrophobicContact CB-CE2 3.95Å; R233-Y255 WeakPolarHBondContact CB-OH 3.44Å; R233-Y255 HydrophobicContact CG-CD1 4.23Å; R233-Y255 HydrophobicContact CG-CE1 3.81Å; R233-Y255 HydrophobicContact CG-CE2 4.32Å
234	C	94.6	Very high	96.7	Very high	4 Å²	4	51 Å²	51	3%	0.027	26%	0.259	C	S	.	.	H	α-helix	trans	-57.4	-48.1	178.1	-168.1	0	0	0	0	111.7	I228 D231 T236 L237 K238	I228-C234 HydrophobicContact CG2-CB 4.44Å; I228-C234 WeakPolarHBondContact O-CB 3.34Å; D231-C234 HydrophobicContact CB-CB 4.04Å; D231-C234 PolarHBondContact O-N 3.39Å; D231-C234 VanDerWaalsContact O-N 3.15Å; D231-C234 WeakPolarHBondContact OD2-CB 3.35Å; D231-C234 PolarHBondContact OD2-N 3.05Å; C234-T236 PolarHBondContact O-N 3.46Å; C234-L237 PolarHBondContact O-N 2.97Å; C234-K238 WeakPolarHBondContact O-CB 3.27Å; C234-K238 WeakPolarHBondContact O-CG 3.28Å; C234-K238 PolarHBondContact O-N 3.08Å
235	Q	96.8	Very high	96.6	Very high	104 Å²	104	49.2 Å²	49.2	49%	0.486	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-44.7	178.2	-69.6	176.7	-1.4	0	0	112.2	L229 D231 E232 R233 K238 L239	L229-Q235 PolarHBondContact O-NE2 2.64Å; D231-Q235 WeakPolarHBondContact O-CG 3.37Å; D231-Q235 PolarHBondContact O-N 2.89Å; E232-Q235 PolarHBondContact O-N 3.37Å; R233-Q235 PolarHBondContact O-N 3.34Å; Q235-K238 PolarHBondContact O-N 3Å; Q235-L239 WeakPolarHBondContact O-CB 3.34Å; Q235-L239 PolarHBondContact O-N 3.27Å
236	T	97.7	Very high	96.6	Very high	7 Å²	7	49.1 Å²	49.1	4%	0.043	26%	0.255	C	S	.	.	H	α-helix	trans	-67.6	-42.7	-179.9	-56	0	0	0	0	111.8	E232 R233 C234 K238 L239 F240 Y255 R260	E232-T236 VanDerWaalsContact O-CB 3.32Å; E232-T236 WeakPolarHBondContact O-CB 3.43Å; E232-T236 PolarHBondContact O-N 2.65Å; E232-T236 PolarHBondContact O-OG1 2.89Å; R233-T236 PolarHBondContact O-N 3.09Å; C234-T236 PolarHBondContact O-N 3.46Å; T236-K238 VanDerWaalsContact C-N 3.33Å; T236-K238 PolarHBondContact O-N 3.19Å; T236-L239 WeakPolarHBondContact O-CB 3.29Å; T236-L239 PolarHBondContact O-N 3.1Å; T236-F240 HydrophobicContact CG2-CD2 3.73Å; T236-F240 HydrophobicContact CG2-CE1 4.37Å; T236-F240 HydrophobicContact CG2-CE2 3.29Å; T236-F240 HydrophobicContact CG2-CG 4.44Å; T236-F240 HydrophobicContact CG2-CZ 3.66Å; T236-F240 WeakPolarHBondContact O-CG 3.35Å; T236-F240 PolarHBondContact O-N 3.46Å; T236-Y255 HydrophobicContact CG2-CD2 3.7Å; T236-Y255 HydrophobicContact CG2-CE2 4.42Å; T236-R260 VanDerWaalsContact OG1-CD 3.3Å; T236-R260 WeakPolarHBondContact OG1-CD 3.36Å
237	L	96.8	Very high	96.5	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-41	177.2	-68.2	-179.9	0	0	0	111.2	F169 R233 C234 F240 T241 A251 E252	F169-L237 HydrophobicContact CB-CD1 4.03Å; F169-L237 HydrophobicContact CD1-CB 4.32Å; F169-L237 HydrophobicContact CD1-CD1 4.34Å; F169-L237 HydrophobicContact CD2-CB 4.49Å; F169-L237 HydrophobicContact CE1-CB 4.26Å; F169-L237 HydrophobicContact CE2-CB 4.41Å; F169-L237 HydrophobicContact CG-CB 4.46Å; F169-L237 HydrophobicContact CG-CD1 4.1Å; F169-L237 HydrophobicContact CZ-CB 4.31Å; R233-L237 HydrophobicContact CG-CD1 3.98Å; R233-L237 HydrophobicContact CG-CG 4.37Å; R233-L237 WeakPolarHBondContact O-CB 3.39Å; R233-L237 VanDerWaalsContact O-CG 3.26Å; R233-L237 WeakPolarHBondContact O-CG 3.41Å; R233-L237 PolarHBondContact O-N 2.62Å; C234-L237 PolarHBondContact O-N 2.97Å; L237-F240 PolarHBondContact O-N 3.34Å; L237-T241 WeakPolarHBondContact O-CB 3.42Å; L237-T241 WeakPolarHBondContact O-CG2 3.37Å; L237-T241 PolarHBondContact O-N 3.38Å; L237-T241 PolarHBondContact O-OG1 2.95Å; L237-A251 HydrophobicContact CD2-CB 3.85Å; L237-E252 HydrophobicContact CD2-CB 4.47Å
238	K	96	Very high	96.3	Very high	57 Å²	57	42.9 Å²	42.9	25%	0.248	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-45.4	172.6	-74.7	-176	177.6	-151.2	0	112.2	E165 F169 C234 Q235 T236 F240 T241 S242	E165-K238 WeakPolarHBondContact OE1-CE 3.2Å; E165-K238 IonicContact OE1-NZ 3Å; E165-K238 WeakPolarHBondContact OE2-CE 3.42Å; E165-K238 IonicContact OE2-NZ 3.61Å; E165-K238 PolarHBondContact OE2-NZ 3.49Å; F169-K238 HydrophobicContact CE2-CG 3.8Å; F169-K238 HydrophobicContact CZ-CG 4.02Å; C234-K238 WeakPolarHBondContact O-CB 3.27Å; C234-K238 WeakPolarHBondContact O-CG 3.28Å; C234-K238 PolarHBondContact O-N 3.08Å; Q235-K238 PolarHBondContact O-N 3Å; T236-K238 VanDerWaalsContact C-N 3.33Å; T236-K238 PolarHBondContact O-N 3.19Å; K238-F240 PolarHBondContact O-N 3.12Å; K238-T241 PolarHBondContact O-N 2.86Å; K238-T241 PolarHBondContact O-OG1 3.01Å; K238-S242 WeakPolarHBondContact O-CB 3.32Å; K238-S242 PolarHBondContact O-N 2.98Å
239	L	97.4	Very high	96.2	Very high	58 Å²	58	50.3 Å²	50.3	30%	0.304	28%	0.275	S	S	.	.	H	α-helix	trans	-58	-51.5	176.6	178.1	66.9	0	0	0	110.8	Q235 T236 S242 R260 F262	Q235-L239 WeakPolarHBondContact O-CB 3.34Å; Q235-L239 PolarHBondContact O-N 3.27Å; T236-L239 WeakPolarHBondContact O-CB 3.29Å; T236-L239 PolarHBondContact O-N 3.1Å; L239-S242 WeakPolarHBondContact O-CB 3.47Å; L239-S242 PolarHBondContact O-N 3.26Å; L239-S242 PolarHBondContact O-OG 3.15Å; L239-R260 WeakPolarHBondContact CD2-O 3.28Å; L239-F262 HydrophobicContact CD1-CD1 4.39Å; L239-F262 HydrophobicContact CD1-CE1 3.68Å; L239-F262 HydrophobicContact CD1-CE2 3.92Å; L239-F262 HydrophobicContact CD1-CZ 3.41Å; L239-F262 VanDerWaalsContact CD1-CZ 3.41Å; L239-F262 HydrophobicContact CD2-CD1 4.46Å; L239-F262 HydrophobicContact CD2-CE1 4.37Å; L239-F262 HydrophobicContact CG-CD1 4.18Å; L239-F262 HydrophobicContact CG-CE1 3.62Å; L239-F262 HydrophobicContact CG-CZ 3.91Å; L239-F262 WeakPolarHBondContact O-CE1 3.5Å
240	F	98.1	Very high	96.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.2	-43.7	-178.5	-67.2	-24.2	0	0	0	112.8	T236 L237 K238 S242 V243 V246 A251 W254 L259 F262 V265	T236-F240 HydrophobicContact CG2-CD2 3.73Å; T236-F240 HydrophobicContact CG2-CE1 4.37Å; T236-F240 HydrophobicContact CG2-CE2 3.29Å; T236-F240 HydrophobicContact CG2-CG 4.44Å; T236-F240 HydrophobicContact CG2-CZ 3.66Å; T236-F240 WeakPolarHBondContact O-CG 3.35Å; T236-F240 PolarHBondContact O-N 3.46Å; L237-F240 PolarHBondContact O-N 3.34Å; K238-F240 PolarHBondContact O-N 3.12Å; F240-S242 PolarHBondContact O-N 3.39Å; F240-V243 PolarHBondContact O-N 2.58Å; F240-V243 VanDerWaalsContact O-N 3.15Å; F240-V246 HydrophobicContact CB-CG1 4.19Å; F240-V246 VanDerWaalsContact O-CB 3.26Å; F240-V246 WeakPolarHBondContact O-CB 3.44Å; F240-V246 VanDerWaalsContact O-CG1 3.24Å; F240-V246 WeakPolarHBondContact O-CG1 3.37Å; F240-A251 HydrophobicContact CB-CB 3.65Å; F240-A251 HydrophobicContact CD2-CB 4.34Å; F240-W254 HydrophobicContact CB-CE3 4.08Å; F240-W254 HydrophobicContact CB-CZ3 4.39Å; F240-W254 HydrophobicContact CD1-CE3 4.06Å; F240-W254 HydrophobicContact CD1-CZ3 4.47Å; F240-W254 HydrophobicContact CD2-CB 3.91Å; F240-W254 HydrophobicContact CD2-CE3 4.02Å; F240-W254 HydrophobicContact CE1-CE3 4.5Å; F240-W254 HydrophobicContact CE2-CB 3.64Å; F240-W254 HydrophobicContact CE2-CE3 4.46Å; F240-W254 AromaticContact CG-CE3 3.8Å; F240-W254 HydrophobicContact CG-CE3 3.8Å; F240-W254 HydrophobicContact CG-CZ3 4.41Å; F240-W254 HydrophobicContact CZ-CB 4.32Å; F240-L259 HydrophobicContact CE2-CB 4.34Å; F240-L259 HydrophobicContact CZ-CB 3.91Å; F240-F262 HydrophobicContact CD1-CD1 4.4Å; F240-F262 HydrophobicContact CD1-CE1 4.45Å; F240-V265 HydrophobicContact CD1-CG2 4.35Å; F240-V265 HydrophobicContact CE1-CG2 3.7Å; F240-V265 HydrophobicContact CZ-CG2 3.94Å
241	T	97.1	Very high	96.3	Very high	39 Å²	39	44.1 Å²	44.1	24%	0.239	24%	0.237	C	C	.	.	H	α-helix	trans	-71.3	-12.2	179.5	54.5	0	0	0	0	114.1	F169 L237 K238 V243 A251	F169-T241 HydrophobicContact CE1-CG2 4.21Å; L237-T241 WeakPolarHBondContact O-CB 3.42Å; L237-T241 WeakPolarHBondContact O-CG2 3.37Å; L237-T241 PolarHBondContact O-N 3.38Å; L237-T241 PolarHBondContact O-OG1 2.95Å; K238-T241 PolarHBondContact O-N 2.86Å; K238-T241 PolarHBondContact O-OG1 3.01Å; T241-V243 PolarHBondContact O-N 3.27Å; T241-A251 HydrophobicContact CG2-CB 3.66Å
242	S	96.6	Very high	96.3	Very high	50 Å²	50	42 Å²	42	35%	0.35	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-16.2	170.4	76.2	0	0	0	0	113.5	K238 L239 F240 Y284	K238-S242 WeakPolarHBondContact O-CB 3.32Å; K238-S242 PolarHBondContact O-N 2.98Å; L239-S242 WeakPolarHBondContact O-CB 3.47Å; L239-S242 PolarHBondContact O-N 3.26Å; L239-S242 PolarHBondContact O-OG 3.15Å; F240-S242 PolarHBondContact O-N 3.39Å; S242-Y284 WeakPolarHBondContact OG-CE2 3.46Å; S242-Y284 PolarHBondContact OG-OH 2.98Å
243	V	97.8	Very high	96.3	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	23%	0.23	C	C	.	.	S	Bend	trans	-83.4	126.1	177.8	-177.2	0	0	0	0	110	F240 T241 G245 V246 F262 F281 Y284	F240-V243 PolarHBondContact O-N 2.58Å; F240-V243 VanDerWaalsContact O-N 3.15Å; T241-V243 PolarHBondContact O-N 3.27Å; V243-G245 PolarHBondContact O-N 3.33Å; V243-V246 HydrophobicContact CB-CB 4.24Å; V243-V246 HydrophobicContact CB-CG2 3.8Å; V243-V246 HydrophobicContact CG1-CG2 3.96Å; V243-V246 WeakPolarHBondContact O-CB 3.34Å; V243-V246 PolarHBondContact O-N 3.02Å; V243-F262 HydrophobicContact CG2-CD1 4.15Å; V243-F262 HydrophobicContact CG2-CE1 3.34Å; V243-F262 HydrophobicContact CG2-CE2 4.47Å; V243-F262 HydrophobicContact CG2-CZ 3.54Å; V243-F281 HydrophobicContact CG1-CD1 4.38Å; V243-F281 HydrophobicContact CG1-CD2 4.03Å; V243-F281 HydrophobicContact CG1-CE1 4.43Å; V243-F281 HydrophobicContact CG1-CE2 4.09Å; V243-F281 HydrophobicContact CG1-CG 4.19Å; V243-F281 HydrophobicContact CG1-CZ 4.29Å; V243-F281 HydrophobicContact CG2-CD1 4.49Å; V243-F281 HydrophobicContact CG2-CE1 4.07Å; V243-F281 HydrophobicContact CG2-CZ 4.26Å; V243-Y284 HydrophobicContact CG2-CD2 3.93Å; V243-Y284 HydrophobicContact CG2-CE2 3.97Å
244	F	97	Very high	96.4	Very high	26 Å²	26	41.1 Å²	41.1	11%	0.114	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	127.1	174.2	175.1	-116.4	0	0	0	111.3	M276 I287 F363 F391 I393 R419	F244-M276 HydrophobicContact CD1-CG 3.8Å; F244-M276 HydrophobicContact CE1-CG 3.31Å; F244-M276 HydrophobicContact CE1-SD 4.28Å; F244-M276 HydrophobicContact CE2-CG 4.08Å; F244-M276 HydrophobicContact CE2-SD 3.97Å; F244-M276 HydrophobicContact CG-CG 4.39Å; F244-M276 HydrophobicContact CZ-CG 3.47Å; F244-M276 VanDerWaalsContact CZ-CG 3.47Å; F244-M276 HydrophobicContact CZ-SD 3.84Å; F244-I287 HydrophobicContact CB-CD1 3.63Å; F244-I287 HydrophobicContact CG-CD1 4.46Å; F244-F363 AromaticContact CE1-CD1 3.75Å; F244-F363 HydrophobicContact CE1-CD1 3.75Å; F244-F363 AromaticContact CE1-CE1 3.54Å; F244-F363 HydrophobicContact CE1-CE1 3.54Å; F244-F363 HydrophobicContact CE1-CG 4.48Å; F244-F363 HydrophobicContact CE1-CZ 4.11Å; F244-F363 HydrophobicContact CZ-CD1 4.18Å; F244-F363 AromaticContact CZ-CE1 3.72Å; F244-F363 HydrophobicContact CZ-CE1 3.72Å; F244-F363 HydrophobicContact CZ-CZ 4.45Å; F244-F391 HydrophobicContact CZ-CB 4.42Å; F244-I393 HydrophobicContact CD1-CD1 3.94Å; F244-I393 HydrophobicContact CE1-CD1 4.07Å; F244-I393 HydrophobicContact CE1-CG1 4.38Å; F244-R419 VanDerWaalsContact CD2-CD 3.47Å; F244-R419 VanDerWaalsContact CE2-NH1 3.29Å
245	G	95.9	Very high	96.6	Very high	21 Å²	21	42.8 Å²	42.8	22%	0.216	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	0.4	-174.9	0	0	0	0	0	115.8	V243 M276 Q277	V243-G245 PolarHBondContact O-N 3.33Å; G245-M276 WeakPolarHBondContact CA-SD 3.48Å; G245-Q277 WeakPolarHBondContact O-CG 3.3Å; G245-Q277 PolarHBondContact O-NE2 3.42Å
246	V	97.5	Very high	96.6	Very high	10 Å²	10	46.9 Å²	46.9	6%	0.061	24%	0.238	C	C	.	.			trans	-107.5	105.2	174.8	-176.6	0	0	0	0	110.2	F240 V243 T250 A251 W254 Q277	F240-V246 HydrophobicContact CB-CG1 4.19Å; F240-V246 VanDerWaalsContact O-CB 3.26Å; F240-V246 WeakPolarHBondContact O-CB 3.44Å; F240-V246 VanDerWaalsContact O-CG1 3.24Å; F240-V246 WeakPolarHBondContact O-CG1 3.37Å; V243-V246 HydrophobicContact CB-CB 4.24Å; V243-V246 HydrophobicContact CB-CG2 3.8Å; V243-V246 HydrophobicContact CG1-CG2 3.96Å; V243-V246 WeakPolarHBondContact O-CB 3.34Å; V243-V246 PolarHBondContact O-N 3.02Å; V246-T250 HydrophobicContact CG1-CG2 4.09Å; V246-A251 HydrophobicContact CG1-CB 4.29Å; V246-W254 HydrophobicContact CB-CH2 4.48Å; V246-W254 HydrophobicContact CB-CZ3 4.29Å; V246-W254 HydrophobicContact CG1-CE3 4.16Å; V246-W254 HydrophobicContact CG1-CH2 4.12Å; V246-W254 HydrophobicContact CG1-CZ3 3.62Å; V246-W254 HydrophobicContact CG2-CH2 3.47Å; V246-W254 VanDerWaalsContact CG2-CH2 3.47Å; V246-W254 HydrophobicContact CG2-CZ3 3.62Å; V246-Q277 HydrophobicContact CG2-CG 3.98Å
247	G	95	Very high	96.5	Very high	31 Å²	31	50.9 Å²	50.9	32%	0.32	25%	0.252	S	S	.	.			trans	-89.2	172.4	173.7	0	0	0	0	0	113.4	K249 T250 A251	G247-K249 VanDerWaalsContact C-N 3.27Å; G247-K249 PolarHBondContact O-N 2.9Å; G247-K249 VanDerWaalsContact O-N 3.16Å; G247-T250 PolarHBondContact O-N 2.87Å; G247-A251 PolarHBondContact O-N 3.41Å
248	P	93	Very high	96.6	Very high	74 Å²	74	52.8 Å²	52.8	48%	0.481	27%	0.273	S	S	.	.	H	α-helix	trans	-53	-39.3	-178.4	-28.7	35.4	0	0	0	114.1	T250 A251 E252	P248-T250 PolarHBondContact O-N 2.85Å; P248-A251 PolarHBondContact O-N 3.05Å; P248-E252 VanDerWaalsContact O-CB 3.25Å; P248-E252 WeakPolarHBondContact O-CB 3.39Å; P248-E252 PolarHBondContact O-N 2.73Å
249	K	93.7	Very high	96.7	Very high	169 Å²	169	50.5 Å²	50.5	74%	0.735	26%	0.263	S	S	*	.	H	α-helix	trans	-63.9	-41.1	178.1	-66.6	-172.9	177.1	-176.7	0	113	G247 K253	G247-K249 VanDerWaalsContact C-N 3.27Å; G247-K249 PolarHBondContact O-N 2.9Å; G247-K249 VanDerWaalsContact O-N 3.16Å; K249-K253 WeakPolarHBondContact O-CB 3.43Å; K249-K253 PolarHBondContact O-N 3.4Å
250	T	96.8	Very high	96.7	Very high	42 Å²	42	51.2 Å²	51.2	26%	0.258	26%	0.262	S	S	.	.	H	α-helix	trans	-70.7	-43.6	177.7	-59.5	0	0	0	0	110.5	V246 G247 P248 E252 K253 W254	V246-T250 HydrophobicContact CG1-CG2 4.09Å; G247-T250 PolarHBondContact O-N 2.87Å; P248-T250 PolarHBondContact O-N 2.85Å; T250-E252 VanDerWaalsContact C-N 3.35Å; T250-E252 PolarHBondContact O-N 2.9Å; T250-K253 WeakPolarHBondContact O-CB 3.1Å; T250-K253 PolarHBondContact O-N 3.29Å; T250-W254 HydrophobicContact CG2-CD2 4.03Å; T250-W254 HydrophobicContact CG2-CE3 4.4Å; T250-W254 HydrophobicContact CG2-CH2 4.05Å; T250-W254 HydrophobicContact CG2-CZ2 3.62Å; T250-W254 HydrophobicContact CG2-CZ3 4.42Å; T250-W254 PolarHBondContact O-N 2.88Å
251	A	97.1	Very high	96.7	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-45.4	175.3	0	0	0	0	0	111.9	L237 F240 T241 V246 G247 P248 K253 W254 Y255	L237-A251 HydrophobicContact CD2-CB 3.85Å; F240-A251 HydrophobicContact CB-CB 3.65Å; F240-A251 HydrophobicContact CD2-CB 4.34Å; T241-A251 HydrophobicContact CG2-CB 3.66Å; V246-A251 HydrophobicContact CG1-CB 4.29Å; G247-A251 PolarHBondContact O-N 3.41Å; P248-A251 PolarHBondContact O-N 3.05Å; A251-K253 PolarHBondContact O-N 2.9Å; A251-W254 PolarHBondContact O-N 2.91Å; A251-Y255 WeakPolarHBondContact O-CB 3.43Å; A251-Y255 PolarHBondContact O-N 3.38Å
252	E	95.6	Very high	96.7	Very high	22 Å²	22	53.1 Å²	53.1	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-43	176	-178.4	63.6	-161.8	0	0	111.9	R233 L237 P248 T250 W254 Y255 R256	R233-E252 IonicContact CZ-OE1 2.69Å; R233-E252 IonicContact CZ-OE2 3.69Å; R233-E252 VanDerWaalsContact NH1-CD 3.26Å; R233-E252 IonicContact NH1-OE1 3.55Å; R233-E252 PolarHBondContact NH1-OE1 2.75Å; R233-E252 IonicContact NH1-OE2 3.73Å; R233-E252 PolarHBondContact NH1-OE2 2.88Å; R233-E252 VanDerWaalsContact NH2-CD 3.32Å; R233-E252 IonicContact NH2-OE1 3.8Å; R233-E252 PolarHBondContact NH2-OE1 3.08Å; R233-E252 IonicContact NH2-OE2 3.18Å; R233-E252 PolarHBondContact NH2-OE2 3.36Å; L237-E252 HydrophobicContact CD2-CB 4.47Å; P248-E252 VanDerWaalsContact O-CB 3.25Å; P248-E252 WeakPolarHBondContact O-CB 3.39Å; P248-E252 PolarHBondContact O-N 2.73Å; T250-E252 VanDerWaalsContact C-N 3.35Å; T250-E252 PolarHBondContact O-N 2.9Å; E252-W254 PolarHBondContact O-N 3.46Å; E252-Y255 PolarHBondContact O-N 2.88Å; E252-R256 VanDerWaalsContact CG-CZ 3.47Å; E252-R256 VanDerWaalsContact CG-NH2 3.32Å; E252-R256 WeakPolarHBondContact O-CB 3.24Å; E252-R256 WeakPolarHBondContact O-CG 3.29Å; E252-R256 PolarHBondContact O-N 3.11Å; E252-R256 IonicContact OE1-CZ 2.95Å; E252-R256 IonicContact OE1-NE 3.05Å; E252-R256 PolarHBondContact OE1-NE 3.34Å; E252-R256 IonicContact OE1-NH2 2.58Å; E252-R256 PolarHBondContact OE1-NH2 3.37Å
253	K	96.3	Very high	96.8	Very high	134 Å²	134	54.8 Å²	54.8	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-59.9	-45.4	175.8	179.9	-178.3	175.7	-177.6	0	111.4	K249 T250 A251 R257	K249-K253 WeakPolarHBondContact O-CB 3.43Å; K249-K253 PolarHBondContact O-N 3.4Å; T250-K253 WeakPolarHBondContact O-CB 3.1Å; T250-K253 PolarHBondContact O-N 3.29Å; A251-K253 PolarHBondContact O-N 2.9Å; K253-R257 WeakPolarHBondContact O-CG 3.3Å; K253-R257 PolarHBondContact O-N 3.3Å
254	W	98	Very high	96.7	Very high	9 Å²	9	57.3 Å²	57.3	3%	0.034	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-43.1	177	-69.3	-16.9	0	0	0	112	F240 V246 T250 A251 E252 R256 R257 L259 V265 I271 L273 F281	F240-W254 HydrophobicContact CB-CE3 4.08Å; F240-W254 HydrophobicContact CB-CZ3 4.39Å; F240-W254 HydrophobicContact CD1-CE3 4.06Å; F240-W254 HydrophobicContact CD1-CZ3 4.47Å; F240-W254 HydrophobicContact CD2-CB 3.91Å; F240-W254 HydrophobicContact CD2-CE3 4.02Å; F240-W254 HydrophobicContact CE1-CE3 4.5Å; F240-W254 HydrophobicContact CE2-CB 3.64Å; F240-W254 HydrophobicContact CE2-CE3 4.46Å; F240-W254 AromaticContact CG-CE3 3.8Å; F240-W254 HydrophobicContact CG-CE3 3.8Å; F240-W254 HydrophobicContact CG-CZ3 4.41Å; F240-W254 HydrophobicContact CZ-CB 4.32Å; V246-W254 HydrophobicContact CB-CH2 4.48Å; V246-W254 HydrophobicContact CB-CZ3 4.29Å; V246-W254 HydrophobicContact CG1-CE3 4.16Å; V246-W254 HydrophobicContact CG1-CH2 4.12Å; V246-W254 HydrophobicContact CG1-CZ3 3.62Å; V246-W254 HydrophobicContact CG2-CH2 3.47Å; V246-W254 VanDerWaalsContact CG2-CH2 3.47Å; V246-W254 HydrophobicContact CG2-CZ3 3.62Å; T250-W254 HydrophobicContact CG2-CD2 4.03Å; T250-W254 HydrophobicContact CG2-CE3 4.4Å; T250-W254 HydrophobicContact CG2-CH2 4.05Å; T250-W254 HydrophobicContact CG2-CZ2 3.62Å; T250-W254 HydrophobicContact CG2-CZ3 4.42Å; T250-W254 PolarHBondContact O-N 2.88Å; A251-W254 PolarHBondContact O-N 2.91Å; E252-W254 PolarHBondContact O-N 3.46Å; W254-R256 PolarHBondContact O-N 3.32Å; W254-R257 WeakPolarHBondContact O-CB 3.19Å; W254-R257 PolarHBondContact O-N 3.05Å; W254-R257 VanDerWaalsContact O-N 3.13Å; W254-L259 HydrophobicContact CB-CB 4.42Å; W254-L259 HydrophobicContact CB-CD1 3.94Å; W254-L259 HydrophobicContact CG-CD1 4.13Å; W254-L259 WeakPolarHBondContact O-CB 3.41Å; W254-L259 WeakPolarHBondContact O-CG 3.39Å; W254-L259 PolarHBondContact O-N 2.99Å; W254-V265 HydrophobicContact CD2-CG1 4.19Å; W254-V265 HydrophobicContact CD2-CG2 3.96Å; W254-V265 HydrophobicContact CE3-CG1 4.23Å; W254-V265 HydrophobicContact CE3-CG2 3.76Å; W254-V265 HydrophobicContact CG-CG2 4.37Å; W254-V265 HydrophobicContact CH2-CG1 3.83Å; W254-V265 HydrophobicContact CZ2-CG1 3.77Å; W254-V265 HydrophobicContact CZ3-CG1 4.06Å; W254-V265 HydrophobicContact CZ3-CG2 4.18Å; W254-I271 HydrophobicContact CZ2-CG2 4.35Å; W254-L273 HydrophobicContact CH2-CD2 4.04Å; W254-L273 HydrophobicContact CZ2-CD2 3.71Å; W254-F281 HydrophobicContact CH2-CE2 4.02Å; W254-F281 HydrophobicContact CH2-CZ 4.17Å; W254-F281 HydrophobicContact CZ3-CZ 4.26Å
255	Y	97.6	Very high	96.7	Very high	39 Å²	39	56.1 Å²	56.1	15%	0.153	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-46.3	176.9	-178.4	-96.9	0	0	0	112.3	R233 T236 A251 E252 R257 G258 R260	R233-Y255 HydrophobicContact CB-CE1 3.98Å; R233-Y255 HydrophobicContact CB-CE2 3.95Å; R233-Y255 WeakPolarHBondContact CB-OH 3.44Å; R233-Y255 HydrophobicContact CG-CD1 4.23Å; R233-Y255 HydrophobicContact CG-CE1 3.81Å; R233-Y255 HydrophobicContact CG-CE2 4.32Å; T236-Y255 HydrophobicContact CG2-CD2 3.7Å; T236-Y255 HydrophobicContact CG2-CE2 4.42Å; A251-Y255 WeakPolarHBondContact O-CB 3.43Å; A251-Y255 PolarHBondContact O-N 3.38Å; E252-Y255 PolarHBondContact O-N 2.88Å; Y255-R257 PolarHBondContact O-N 3.07Å; Y255-G258 PolarHBondContact O-N 3.09Å; Y255-R260 VanDerWaalsContact CD2-NH1 3.32Å; Y255-R260 PolarHBondContact O-NH1 2.92Å
256	R	96.8	Very high	96.7	Very high	189 Å²	189	60.2 Å²	60.2	71%	0.713	31%	0.308	S	S	*	.	H	α-helix	trans	-62.7	-24.1	177.4	-73.3	178.6	-169.5	165.8	5.3	113.5	E252 W254 G258	E252-R256 VanDerWaalsContact CG-CZ 3.47Å; E252-R256 VanDerWaalsContact CG-NH2 3.32Å; E252-R256 WeakPolarHBondContact O-CB 3.24Å; E252-R256 WeakPolarHBondContact O-CG 3.29Å; E252-R256 PolarHBondContact O-N 3.11Å; E252-R256 IonicContact OE1-CZ 2.95Å; E252-R256 IonicContact OE1-NE 3.05Å; E252-R256 PolarHBondContact OE1-NE 3.34Å; E252-R256 IonicContact OE1-NH2 2.58Å; E252-R256 PolarHBondContact OE1-NH2 3.37Å; W254-R256 PolarHBondContact O-N 3.32Å; R256-G258 PolarHBondContact O-N 3.24Å
257	R	97.4	Very high	96.7	Very high	91 Å²	91	63.1 Å²	63.1	34%	0.343	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	0.3	172.5	-74.2	179	56	159.3	-2.3	113.8	K253 W254 Y255 L259 D270	K253-R257 WeakPolarHBondContact O-CG 3.3Å; K253-R257 PolarHBondContact O-N 3.3Å; W254-R257 WeakPolarHBondContact O-CB 3.19Å; W254-R257 PolarHBondContact O-N 3.05Å; W254-R257 VanDerWaalsContact O-N 3.13Å; Y255-R257 PolarHBondContact O-N 3.07Å; R257-L259 HydrophobicContact CB-CD1 4.44Å; R257-L259 HydrophobicContact CB-CG 4.19Å; R257-D270 IonicContact CZ-OD1 2.76Å; R257-D270 IonicContact CZ-OD2 3.78Å; R257-D270 IonicContact NH1-OD1 3.89Å; R257-D270 IonicContact NH1-OD2 3.7Å; R257-D270 PolarHBondContact NH1-OD2 3.17Å; R257-D270 IonicContact NH2-OD1 2.93Å; R257-D270 PolarHBondContact NH2-OD1 2.98Å; R257-D270 IonicContact NH2-OD2 3.01Å; R257-D270 PolarHBondContact NH2-OD2 2.65Å
258	G	97.6	Very high	96.7	Very high	45 Å²	45	65 Å²	65	46%	0.464	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	7.1	-178.5	0	0	0	0	0	114.5	Y255 R256 R260	Y255-G258 PolarHBondContact O-N 3.09Å; R256-G258 PolarHBondContact O-N 3.24Å; G258-R260 VanDerWaalsContact C-NH1 3.26Å
259	L	98.4	Very high	96.7	Very high	8 Å²	8	67.2 Å²	67.2	4%	0.042	35%	0.348	C	S	.	.			trans	-78.6	138.2	179.3	-47.3	176.3	0	0	0	109.8	F240 W254 R257 D264 V265 Q268 I271	F240-L259 HydrophobicContact CE2-CB 4.34Å; F240-L259 HydrophobicContact CZ-CB 3.91Å; W254-L259 HydrophobicContact CB-CB 4.42Å; W254-L259 HydrophobicContact CB-CD1 3.94Å; W254-L259 HydrophobicContact CG-CD1 4.13Å; W254-L259 WeakPolarHBondContact O-CB 3.41Å; W254-L259 WeakPolarHBondContact O-CG 3.39Å; W254-L259 PolarHBondContact O-N 2.99Å; R257-L259 HydrophobicContact CB-CD1 4.44Å; R257-L259 HydrophobicContact CB-CG 4.19Å; L259-D264 HydrophobicContact CB-CB 4.07Å; L259-D264 HydrophobicContact CD2-CB 3.86Å; L259-V265 HydrophobicContact CB-CG2 4.4Å; L259-V265 HydrophobicContact CD1-CG2 4.05Å; L259-Q268 HydrophobicContact CD1-CG 4.3Å; L259-Q268 HydrophobicContact CD2-CG 3.76Å; L259-I271 HydrophobicContact CD1-CD1 3.43Å; L259-I271 VanDerWaalsContact CD1-CD1 3.43Å
260	R	98.1	Very high	96.7	Very high	73 Å²	73	63.2 Å²	63.2	28%	0.275	34%	0.335	S	S	.	.			trans	-129.9	-17.6	-177.8	-60.4	-61.2	179.4	-95.1	1.5	113.9	E232 T236 L239 Y255 G258 D264	E232-R260 WeakPolarHBondContact OE1-CD 3.42Å; E232-R260 IonicContact OE1-CZ 3.17Å; E232-R260 IonicContact OE1-NE 3.32Å; E232-R260 PolarHBondContact OE1-NE 3.34Å; E232-R260 IonicContact OE1-NH2 2.7Å; T236-R260 VanDerWaalsContact OG1-CD 3.3Å; T236-R260 WeakPolarHBondContact OG1-CD 3.36Å; L239-R260 WeakPolarHBondContact CD2-O 3.28Å; Y255-R260 VanDerWaalsContact CD2-NH1 3.32Å; Y255-R260 PolarHBondContact O-NH1 2.92Å; G258-R260 VanDerWaalsContact C-NH1 3.26Å; R260-D264 WeakPolarHBondContact CA-OD2 3.49Å; R260-D264 PolarHBondContact N-OD2 2.86Å
261	S	98.1	Very high	96.6	Very high	37 Å²	37	62.4 Å²	62.4	26%	0.259	33%	0.328	S	S	.	.	S	Bend	trans	-130	163.2	-177	86.4	0	0	0	0	113	S263 D264 V265	S261-S263 VanDerWaalsContact C-N 3.25Å; S261-S263 PolarHBondContact O-N 2.78Å; S261-S263 WeakPolarHBondContact OG-CB 3.13Å; S261-S263 PolarHBondContact OG-N 2.75Å; S261-D264 PolarHBondContact N-OD2 3.3Å; S261-D264 WeakPolarHBondContact O-CB 3.45Å; S261-D264 PolarHBondContact O-N 3.46Å; S261-D264 PolarHBondContact OG-N 3.05Å; S261-D264 PolarHBondContact OG-OD1 3.49Å; S261-D264 PolarHBondContact OG-OD2 3.48Å; S261-V265 PolarHBondContact O-N 3.26Å
262	F	97.3	Very high	96.5	Very high	43 Å²	43	70.3 Å²	70.3	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-61.4	-36.3	170.3	-63.3	-24.2	0	0	0	112.2	L239 F240 V243 D264 V265 L266 F281 Y284	L239-F262 HydrophobicContact CD1-CD1 4.39Å; L239-F262 HydrophobicContact CD1-CE1 3.68Å; L239-F262 HydrophobicContact CD1-CE2 3.92Å; L239-F262 HydrophobicContact CD1-CZ 3.41Å; L239-F262 VanDerWaalsContact CD1-CZ 3.41Å; L239-F262 HydrophobicContact CD2-CD1 4.46Å; L239-F262 HydrophobicContact CD2-CE1 4.37Å; L239-F262 HydrophobicContact CG-CD1 4.18Å; L239-F262 HydrophobicContact CG-CE1 3.62Å; L239-F262 HydrophobicContact CG-CZ 3.91Å; L239-F262 WeakPolarHBondContact O-CE1 3.5Å; F240-F262 HydrophobicContact CD1-CD1 4.4Å; F240-F262 HydrophobicContact CD1-CE1 4.45Å; V243-F262 HydrophobicContact CG2-CD1 4.15Å; V243-F262 HydrophobicContact CG2-CE1 3.34Å; V243-F262 HydrophobicContact CG2-CE2 4.47Å; V243-F262 HydrophobicContact CG2-CZ 3.54Å; F262-D264 VanDerWaalsContact C-N 3.27Å; F262-D264 PolarHBondContact O-N 3.01Å; F262-V265 PolarHBondContact O-N 3.42Å; F262-L266 WeakPolarHBondContact O-CB 3.33Å; F262-L266 VanDerWaalsContact O-CG 3.3Å; F262-L266 WeakPolarHBondContact O-CG 3.4Å; F262-L266 PolarHBondContact O-N 3.41Å; F262-F281 HydrophobicContact CB-CE1 3.95Å; F262-F281 AromaticContact CD1-CE1 3.72Å; F262-F281 HydrophobicContact CD1-CE1 3.72Å; F262-F281 HydrophobicContact CD1-CZ 4.42Å; F262-F281 HydrophobicContact CE1-CE1 4.36Å; F262-F281 AromaticContact CG-CE1 3.86Å; F262-F281 HydrophobicContact CG-CE1 3.86Å; F262-Y284 AromaticContact CE2-CD1 3.9Å; F262-Y284 HydrophobicContact CE2-CD1 3.9Å; F262-Y284 HydrophobicContact CE2-CD2 4.25Å; F262-Y284 AromaticContact CE2-CE1 3.55Å; F262-Y284 HydrophobicContact CE2-CE1 3.55Å; F262-Y284 AromaticContact CE2-CE2 3.92Å; F262-Y284 HydrophobicContact CE2-CE2 3.92Å; F262-Y284 HydrophobicContact CE2-CG 4.24Å; F262-Y284 AromaticContact CE2-CZ 3.55Å; F262-Y284 HydrophobicContact CZ-CD2 4.23Å; F262-Y284 HydrophobicContact CZ-CE1 4.1Å; F262-Y284 AromaticContact CZ-CE2 3.66Å; F262-Y284 HydrophobicContact CZ-CE2 3.66Å; F262-Y284 AromaticContact CZ-CZ 3.58Å
263	S	97.1	Very high	96.5	Very high	85 Å²	85	70.6 Å²	70.6	59%	0.594	37%	0.367	S	S	*	.	H	α-helix	trans	-61.4	-40.2	175.9	-171.7	0	0	0	0	111	S261 L266 A267	S261-S263 VanDerWaalsContact C-N 3.25Å; S261-S263 PolarHBondContact O-N 2.78Å; S261-S263 WeakPolarHBondContact OG-CB 3.13Å; S261-S263 PolarHBondContact OG-N 2.75Å; S263-L266 PolarHBondContact O-N 2.97Å; S263-A267 WeakPolarHBondContact O-CB 3.45Å; S263-A267 PolarHBondContact O-N 2.96Å
264	D	97.2	Very high	96.5	Very high	55 Å²	55	67.7 Å²	67.7	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-49	178.2	-51.9	-13.2	0	0	0	109.5	L259 R260 S261 F262 L266 A267 Q268	L259-D264 HydrophobicContact CB-CB 4.07Å; L259-D264 HydrophobicContact CD2-CB 3.86Å; R260-D264 WeakPolarHBondContact CA-OD2 3.49Å; R260-D264 PolarHBondContact N-OD2 2.86Å; S261-D264 PolarHBondContact N-OD2 3.3Å; S261-D264 WeakPolarHBondContact O-CB 3.45Å; S261-D264 PolarHBondContact O-N 3.46Å; S261-D264 PolarHBondContact OG-N 3.05Å; S261-D264 PolarHBondContact OG-OD1 3.49Å; S261-D264 PolarHBondContact OG-OD2 3.48Å; F262-D264 VanDerWaalsContact C-N 3.27Å; F262-D264 PolarHBondContact O-N 3.01Å; D264-L266 PolarHBondContact O-N 3.06Å; D264-A267 PolarHBondContact O-N 3.46Å; D264-Q268 VanDerWaalsContact O-CG 3.29Å; D264-Q268 WeakPolarHBondContact O-CG 3.26Å; D264-Q268 PolarHBondContact O-N 3.35Å
265	V	97.3	Very high	96.5	Very high	2 Å²	2	74.2 Å²	74.2	1%	0.012	38%	0.383	C	S	.	.	H	α-helix	trans	-59.7	-45.9	179.8	177.3	0	0	0	0	111.5	F240 W254 L259 S261 F262 A267 Q268 I271 L273 F281	F240-V265 HydrophobicContact CD1-CG2 4.35Å; F240-V265 HydrophobicContact CE1-CG2 3.7Å; F240-V265 HydrophobicContact CZ-CG2 3.94Å; W254-V265 HydrophobicContact CD2-CG1 4.19Å; W254-V265 HydrophobicContact CD2-CG2 3.96Å; W254-V265 HydrophobicContact CE3-CG1 4.23Å; W254-V265 HydrophobicContact CE3-CG2 3.76Å; W254-V265 HydrophobicContact CG-CG2 4.37Å; W254-V265 HydrophobicContact CH2-CG1 3.83Å; W254-V265 HydrophobicContact CZ2-CG1 3.77Å; W254-V265 HydrophobicContact CZ3-CG1 4.06Å; W254-V265 HydrophobicContact CZ3-CG2 4.18Å; L259-V265 HydrophobicContact CB-CG2 4.4Å; L259-V265 HydrophobicContact CD1-CG2 4.05Å; S261-V265 PolarHBondContact O-N 3.26Å; F262-V265 PolarHBondContact O-N 3.42Å; V265-A267 VanDerWaalsContact C-N 3.33Å; V265-A267 PolarHBondContact O-N 2.92Å; V265-Q268 PolarHBondContact O-N 3.29Å; V265-I271 HydrophobicContact CG1-CD1 4.45Å; V265-I271 HydrophobicContact CG1-CG2 4.25Å; V265-L273 HydrophobicContact CG1-CD2 4.26Å; V265-F281 HydrophobicContact CB-CZ 4.42Å; V265-F281 HydrophobicContact CG1-CE2 4.35Å; V265-F281 HydrophobicContact CG1-CZ 4.01Å
266	L	95.8	Very high	96.4	Very high	106 Å²	106	75 Å²	75	56%	0.555	39%	0.388	S	S	*	.	H	α-helix	trans	-73	-23.7	-177.4	-66.3	173.3	0	0	0	113.4	F262 S263 D264 L273 F281	F262-L266 WeakPolarHBondContact O-CB 3.33Å; F262-L266 VanDerWaalsContact O-CG 3.3Å; F262-L266 WeakPolarHBondContact O-CG 3.4Å; F262-L266 PolarHBondContact O-N 3.41Å; S263-L266 PolarHBondContact O-N 2.97Å; D264-L266 PolarHBondContact O-N 3.06Å; L266-L273 HydrophobicContact CD2-CD1 3.91Å; L266-F281 HydrophobicContact CD1-CD1 4.32Å; L266-F281 HydrophobicContact CD2-CD1 4.33Å; L266-F281 HydrophobicContact CD2-CD2 4.37Å; L266-F281 HydrophobicContact CD2-CG 4.22Å; L266-F281 HydrophobicContact CG-CD1 4.47Å
267	A	96.1	Very high	96.5	Very high	72 Å²	72	66.7 Å²	66.7	60%	0.595	36%	0.357	S	S	*	.	H	α-helix	trans	-83.1	-12.9	177.4	0	0	0	0	0	113.6	S263 D264 V265 P269	S263-A267 WeakPolarHBondContact O-CB 3.45Å; S263-A267 PolarHBondContact O-N 2.96Å; D264-A267 PolarHBondContact O-N 3.46Å; V265-A267 VanDerWaalsContact C-N 3.33Å; V265-A267 PolarHBondContact O-N 2.92Å; A267-P269 VanDerWaalsContact O-CD 3.32Å; A267-P269 WeakPolarHBondContact O-CD 3.5Å
268	Q	95.3	Very high	96.5	Very high	71 Å²	71	67.6 Å²	67.6	33%	0.332	37%	0.366	S	S	.	.			trans	-81.6	112.7	-179.8	-67.8	-65.6	-63.7	0	0	111.2	L259 D264 V265 D270 I271	L259-Q268 HydrophobicContact CD1-CG 4.3Å; L259-Q268 HydrophobicContact CD2-CG 3.76Å; D264-Q268 VanDerWaalsContact O-CG 3.29Å; D264-Q268 WeakPolarHBondContact O-CG 3.26Å; D264-Q268 PolarHBondContact O-N 3.35Å; V265-Q268 PolarHBondContact O-N 3.29Å; Q268-D270 VanDerWaalsContact C-N 3.27Å; Q268-D270 PolarHBondContact O-N 3.43Å; Q268-I271 HydrophobicContact CB-CB 4.11Å; Q268-I271 HydrophobicContact CB-CD1 3.6Å; Q268-I271 HydrophobicContact CB-CG1 3.66Å; Q268-I271 HydrophobicContact CG-CD1 3.84Å; Q268-I271 HydrophobicContact CG-CG1 4.38Å; Q268-I271 PolarHBondContact O-N 2.97Å
269	P	92.7	Very high	96.5	Very high	120 Å²	120	66.1 Å²	66.1	78%	0.779	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-22.4	-175.1	28.4	-35.4	0	0	0	113.7	A267	A267-P269 VanDerWaalsContact O-CD 3.32Å; A267-P269 WeakPolarHBondContact O-CD 3.5Å
270	D	94.1	Very high	96.5	Very high	84 Å²	84	65.8 Å²	65.8	45%	0.449	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.5	179.8	70.7	-52.1	0	0	0	113	R257 Q268 H272	R257-D270 IonicContact CZ-OD1 2.76Å; R257-D270 IonicContact CZ-OD2 3.78Å; R257-D270 IonicContact NH1-OD1 3.89Å; R257-D270 IonicContact NH1-OD2 3.7Å; R257-D270 PolarHBondContact NH1-OD2 3.17Å; R257-D270 IonicContact NH2-OD1 2.93Å; R257-D270 PolarHBondContact NH2-OD1 2.98Å; R257-D270 IonicContact NH2-OD2 3.01Å; R257-D270 PolarHBondContact NH2-OD2 2.65Å; Q268-D270 VanDerWaalsContact C-N 3.27Å; Q268-D270 PolarHBondContact O-N 3.43Å; D270-H272 PolarHBondContact O-N 3.4Å; D270-H272 PolarHBondContact O-ND1 3.28Å
271	I	94.7	Very high	96.4	Very high	25 Å²	25	63.8 Å²	63.8	13%	0.128	34%	0.34	C	S	.	.			trans	-83.1	106.5	175	-64.9	-176.2	0	0	0	109.8	W254 L259 V265 Q268 L273	W254-I271 HydrophobicContact CZ2-CG2 4.35Å; L259-I271 HydrophobicContact CD1-CD1 3.43Å; L259-I271 VanDerWaalsContact CD1-CD1 3.43Å; V265-I271 HydrophobicContact CG1-CD1 4.45Å; V265-I271 HydrophobicContact CG1-CG2 4.25Å; Q268-I271 HydrophobicContact CB-CB 4.11Å; Q268-I271 HydrophobicContact CB-CD1 3.6Å; Q268-I271 HydrophobicContact CB-CG1 3.66Å; Q268-I271 HydrophobicContact CG-CD1 3.84Å; Q268-I271 HydrophobicContact CG-CG1 4.38Å; Q268-I271 PolarHBondContact O-N 2.97Å; I271-L273 HydrophobicContact CG2-CD2 3.86Å; I271-L273 HydrophobicContact CG2-CG 4.47Å; I271-L273 PolarHBondContact O-N 3.44Å
272	H	94.5	Very high	96.4	Very high	167 Å²	167	68.3 Å²	68.3	77%	0.773	36%	0.36	S	S	*	.			trans	-93.4	102.9	175.3	-64	77.5	0	0	0	109.7	D270	D270-H272 PolarHBondContact O-N 3.4Å; D270-H272 PolarHBondContact O-ND1 3.28Å
273	L	96.8	Very high	96.4	Very high	28 Å²	28	67.2 Å²	67.2	15%	0.147	36%	0.356	C	S	.	.			trans	-71.4	132.1	175.3	-59.8	-179.3	0	0	0	110.2	W254 V265 L266 I271 Q277 Q278 F281	W254-L273 HydrophobicContact CH2-CD2 4.04Å; W254-L273 HydrophobicContact CZ2-CD2 3.71Å; V265-L273 HydrophobicContact CG1-CD2 4.26Å; L266-L273 HydrophobicContact CD2-CD1 3.91Å; I271-L273 HydrophobicContact CG2-CD2 3.86Å; I271-L273 HydrophobicContact CG2-CG 4.47Å; I271-L273 PolarHBondContact O-N 3.44Å; L273-Q277 HydrophobicContact CB-CB 4.05Å; L273-Q277 HydrophobicContact CD2-CB 4.23Å; L273-Q278 HydrophobicContact CB-CG 3.72Å; L273-Q278 PolarHBondContact O-NE2 3.38Å; L273-F281 HydrophobicContact CD1-CD2 3.62Å; L273-F281 HydrophobicContact CD1-CE2 3.82Å; L273-F281 HydrophobicContact CD2-CE2 3.98Å
274	N	96.3	Very high	96.3	Very high	72 Å²	72	65.9 Å²	65.9	39%	0.385	34%	0.338	S	S	.	.			trans	-72.1	166.7	171	71.6	39.4	0	0	0	111	M276 Q277 Q278	N274-M276 PolarHBondContact O-N 2.9Å; N274-M276 VanDerWaalsContact O-N 3.15Å; N274-M276 WeakPolarHBondContact OD1-CA 3.46Å; N274-M276 VanDerWaalsContact OD1-CB 3.3Å; N274-M276 WeakPolarHBondContact OD1-CB 3.3Å; N274-M276 PolarHBondContact OD1-N 3.43Å; N274-Q277 PolarHBondContact ND2-NE2 2.66Å; N274-Q277 WeakPolarHBondContact O-CB 3.49Å; N274-Q277 PolarHBondContact O-N 3.47Å; N274-Q277 WeakPolarHBondContact OD1-CG 3.34Å; N274-Q277 PolarHBondContact OD1-N 3.39Å; N274-Q278 WeakPolarHBondContact O-CG 3.29Å; N274-Q278 PolarHBondContact O-N 2.9Å
275	R	96.8	Very high	96.2	Very high	147 Å²	147	65.6 Å²	65.6	56%	0.555	35%	0.348	S	S	*	.	H	α-helix	trans	-54.4	-37	-177	-169.2	-172.4	172	-153.2	-5.9	113.5	S279 F363 S364	R275-S279 WeakPolarHBondContact O-CB 3.48Å; R275-S279 PolarHBondContact O-N 3.5Å; R275-S279 PolarHBondContact O-OG 3.43Å; R275-F363 HydrophobicContact CB-CE2 4.46Å; R275-F363 HydrophobicContact CG-CD2 4.36Å; R275-F363 HydrophobicContact CG-CE2 3.95Å; R275-S364 PolarHBondContact NH1-O 3.47Å
276	M	97.1	Very high	96.1	Very high	55 Å²	55	65.7 Å²	65.7	27%	0.271	35%	0.349	S	S	.	.	H	α-helix	trans	-67.3	-46.3	178.8	-161.2	-172	-28	0	0	110.9	F244 G245 N274 S279 G280 F363	F244-M276 HydrophobicContact CD1-CG 3.8Å; F244-M276 HydrophobicContact CE1-CG 3.31Å; F244-M276 HydrophobicContact CE1-SD 4.28Å; F244-M276 HydrophobicContact CE2-CG 4.08Å; F244-M276 HydrophobicContact CE2-SD 3.97Å; F244-M276 HydrophobicContact CG-CG 4.39Å; F244-M276 HydrophobicContact CZ-CG 3.47Å; F244-M276 VanDerWaalsContact CZ-CG 3.47Å; F244-M276 HydrophobicContact CZ-SD 3.84Å; G245-M276 WeakPolarHBondContact CA-SD 3.48Å; N274-M276 PolarHBondContact O-N 2.9Å; N274-M276 VanDerWaalsContact O-N 3.15Å; N274-M276 WeakPolarHBondContact OD1-CA 3.46Å; N274-M276 VanDerWaalsContact OD1-CB 3.3Å; N274-M276 WeakPolarHBondContact OD1-CB 3.3Å; N274-M276 PolarHBondContact OD1-N 3.43Å; M276-S279 PolarHBondContact O-N 3.37Å; M276-G280 PolarHBondContact O-N 2.96Å; M276-F363 HydrophobicContact CB-CE2 4.33Å; M276-F363 HydrophobicContact CB-CZ 3.95Å; M276-F363 HydrophobicContact CG-CE1 4.28Å; M276-F363 HydrophobicContact CG-CZ 3.83Å
277	Q	97.8	Very high	96.1	Very high	14 Å²	14	61.5 Å²	61.5	7%	0.065	33%	0.327	C	S	.	.	H	α-helix	trans	-64.5	-44.5	176.8	-69	164.1	-9.4	0	0	111.8	G245 V246 L273 N274 S279 G280 F281	G245-Q277 WeakPolarHBondContact O-CG 3.3Å; G245-Q277 PolarHBondContact O-NE2 3.42Å; V246-Q277 HydrophobicContact CG2-CG 3.98Å; L273-Q277 HydrophobicContact CB-CB 4.05Å; L273-Q277 HydrophobicContact CD2-CB 4.23Å; N274-Q277 PolarHBondContact ND2-NE2 2.66Å; N274-Q277 WeakPolarHBondContact O-CB 3.49Å; N274-Q277 PolarHBondContact O-N 3.47Å; N274-Q277 WeakPolarHBondContact OD1-CG 3.34Å; N274-Q277 PolarHBondContact OD1-N 3.39Å; Q277-S279 VanDerWaalsContact C-N 3.3Å; Q277-S279 PolarHBondContact O-N 3.5Å; Q277-G280 WeakPolarHBondContact O-CA 3.33Å; Q277-G280 PolarHBondContact O-N 3.48Å; Q277-G280 VanDerWaalsContact O-N 3.13Å; Q277-F281 VanDerWaalsContact O-CD2 3.26Å; Q277-F281 WeakPolarHBondContact O-CD2 3.29Å; Q277-F281 PolarHBondContact O-N 2.91Å
278	Q	97.7	Very high	96	Very high	110 Å²	110	60.6 Å²	60.6	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-55.3	-47.8	174.6	-69.1	172.3	6.3	0	0	110.9	L273 N274 G280 F281 L282	L273-Q278 HydrophobicContact CB-CG 3.72Å; L273-Q278 PolarHBondContact O-NE2 3.38Å; N274-Q278 WeakPolarHBondContact O-CG 3.29Å; N274-Q278 PolarHBondContact O-N 2.9Å; Q278-G280 VanDerWaalsContact C-N 3.33Å; Q278-G280 PolarHBondContact O-N 2.71Å; Q278-F281 PolarHBondContact O-N 3.27Å; Q278-L282 VanDerWaalsContact O-CB 3.3Å; Q278-L282 WeakPolarHBondContact O-CB 3.47Å; Q278-L282 PolarHBondContact O-N 3.45Å
279	S	97.6	Very high	95.9	Very high	15 Å²	15	59.3 Å²	59.3	11%	0.105	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-36	177.5	-54.3	0	0	0	0	112	R275 M276 Q277 L282 H283 F363	R275-S279 WeakPolarHBondContact O-CB 3.48Å; R275-S279 PolarHBondContact O-N 3.5Å; R275-S279 PolarHBondContact O-OG 3.43Å; M276-S279 PolarHBondContact O-N 3.37Å; Q277-S279 VanDerWaalsContact C-N 3.3Å; Q277-S279 PolarHBondContact O-N 3.5Å; S279-L282 PolarHBondContact O-N 2.91Å; S279-H283 PolarHBondContact O-CD2 3.24Å; S279-H283 PolarHBondContact O-N 3.5Å; S279-F363 WeakPolarHBondContact OG-CD2 3.23Å
280	G	97.4	Very high	96.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-45.1	175.2	0	0	0	0	0	112.9	M276 Q277 Q278 Y284	M276-G280 PolarHBondContact O-N 2.96Å; Q277-G280 WeakPolarHBondContact O-CA 3.33Å; Q277-G280 PolarHBondContact O-N 3.48Å; Q277-G280 VanDerWaalsContact O-N 3.13Å; Q278-G280 VanDerWaalsContact C-N 3.33Å; Q278-G280 PolarHBondContact O-N 2.71Å; G280-Y284 VanDerWaalsContact O-CA 3.24Å; G280-Y284 WeakPolarHBondContact O-CA 3.48Å; G280-Y284 VanDerWaalsContact O-CB 3.29Å; G280-Y284 WeakPolarHBondContact O-CB 3.49Å; G280-Y284 PolarHBondContact O-N 2.92Å
281	F	97.8	Very high	96.2	Very high	31 Å²	31	51.5 Å²	51.5	14%	0.136	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-45.6	173.4	-80.2	-72.9	0	0	0	111.9	V243 W254 F262 V265 L266 L273 Q277 Q278 H283 Y284	V243-F281 HydrophobicContact CG1-CD1 4.38Å; V243-F281 HydrophobicContact CG1-CD2 4.03Å; V243-F281 HydrophobicContact CG1-CE1 4.43Å; V243-F281 HydrophobicContact CG1-CE2 4.09Å; V243-F281 HydrophobicContact CG1-CG 4.19Å; V243-F281 HydrophobicContact CG1-CZ 4.29Å; V243-F281 HydrophobicContact CG2-CD1 4.49Å; V243-F281 HydrophobicContact CG2-CE1 4.07Å; V243-F281 HydrophobicContact CG2-CZ 4.26Å; W254-F281 HydrophobicContact CH2-CE2 4.02Å; W254-F281 HydrophobicContact CH2-CZ 4.17Å; W254-F281 HydrophobicContact CZ3-CZ 4.26Å; F262-F281 HydrophobicContact CB-CE1 3.95Å; F262-F281 AromaticContact CD1-CE1 3.72Å; F262-F281 HydrophobicContact CD1-CE1 3.72Å; F262-F281 HydrophobicContact CD1-CZ 4.42Å; F262-F281 HydrophobicContact CE1-CE1 4.36Å; F262-F281 AromaticContact CG-CE1 3.86Å; F262-F281 HydrophobicContact CG-CE1 3.86Å; V265-F281 HydrophobicContact CB-CZ 4.42Å; V265-F281 HydrophobicContact CG1-CE2 4.35Å; V265-F281 HydrophobicContact CG1-CZ 4.01Å; L266-F281 HydrophobicContact CD1-CD1 4.32Å; L266-F281 HydrophobicContact CD2-CD1 4.33Å; L266-F281 HydrophobicContact CD2-CD2 4.37Å; L266-F281 HydrophobicContact CD2-CG 4.22Å; L266-F281 HydrophobicContact CG-CD1 4.47Å; L273-F281 HydrophobicContact CD1-CD2 3.62Å; L273-F281 HydrophobicContact CD1-CE2 3.82Å; L273-F281 HydrophobicContact CD2-CE2 3.98Å; Q277-F281 VanDerWaalsContact O-CD2 3.26Å; Q277-F281 WeakPolarHBondContact O-CD2 3.29Å; Q277-F281 PolarHBondContact O-N 2.91Å; Q278-F281 PolarHBondContact O-N 3.27Å; F281-H283 VanDerWaalsContact C-N 3.27Å; F281-H283 PolarHBondContact O-N 3.3Å; F281-Y284 WeakPolarHBondContact O-CB 3.45Å; F281-Y284 PolarHBondContact O-N 3.29Å
282	L	97.1	Very high	96.4	Very high	132 Å²	132	51 Å²	51	69%	0.691	26%	0.263	S	S	*	.	H	α-helix	trans	-58.4	-38.6	-178	-178.9	61.9	0	0	0	112.6	Q278 S279	Q278-L282 VanDerWaalsContact O-CB 3.3Å; Q278-L282 WeakPolarHBondContact O-CB 3.47Å; Q278-L282 PolarHBondContact O-N 3.45Å; S279-L282 PolarHBondContact O-N 2.91Å
283	H	96.6	Very high	96.5	Very high	20 Å²	20	47.4 Å²	47.4	9%	0.093	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	11	-177.1	-59.6	-54.2	0	0	0	113.7	S279 F281 G285 D286 I287 A417	S279-H283 PolarHBondContact O-CD2 3.24Å; S279-H283 PolarHBondContact O-N 3.5Å; F281-H283 VanDerWaalsContact C-N 3.27Å; F281-H283 PolarHBondContact O-N 3.3Å; H283-G285 VanDerWaalsContact C-N 3.3Å; H283-G285 PolarHBondContact O-N 3.46Å; H283-D286 PolarHBondContact O-N 3.35Å; H283-I287 HydrophobicContact CB-CD1 4.43Å; H283-I287 HydrophobicContact CB-CG2 4.1Å; H283-I287 WeakPolarHBondContact O-CG1 3.44Å; H283-I287 PolarHBondContact O-N 2.96Å; H283-A417 HydrophobicContact CB-CB 3.88Å
284	Y	96.5	Very high	96.5	Very high	58 Å²	58	47.1 Å²	47.1	23%	0.227	25%	0.248	C	C	.	.	H	α-helix	trans	-52	-46.6	-172	-178.3	-96.7	0	0	0	112.8	S242 V243 F262 G280 F281 D286 I287 S288	S242-Y284 WeakPolarHBondContact OG-CE2 3.46Å; S242-Y284 PolarHBondContact OG-OH 2.98Å; V243-Y284 HydrophobicContact CG2-CD2 3.93Å; V243-Y284 HydrophobicContact CG2-CE2 3.97Å; F262-Y284 AromaticContact CE2-CD1 3.9Å; F262-Y284 HydrophobicContact CE2-CD1 3.9Å; F262-Y284 HydrophobicContact CE2-CD2 4.25Å; F262-Y284 AromaticContact CE2-CE1 3.55Å; F262-Y284 HydrophobicContact CE2-CE1 3.55Å; F262-Y284 AromaticContact CE2-CE2 3.92Å; F262-Y284 HydrophobicContact CE2-CE2 3.92Å; F262-Y284 HydrophobicContact CE2-CG 4.24Å; F262-Y284 AromaticContact CE2-CZ 3.55Å; F262-Y284 HydrophobicContact CZ-CD2 4.23Å; F262-Y284 HydrophobicContact CZ-CE1 4.1Å; F262-Y284 AromaticContact CZ-CE2 3.66Å; F262-Y284 HydrophobicContact CZ-CE2 3.66Å; F262-Y284 AromaticContact CZ-CZ 3.58Å; G280-Y284 VanDerWaalsContact O-CA 3.24Å; G280-Y284 WeakPolarHBondContact O-CA 3.48Å; G280-Y284 VanDerWaalsContact O-CB 3.29Å; G280-Y284 WeakPolarHBondContact O-CB 3.49Å; G280-Y284 PolarHBondContact O-N 2.92Å; F281-Y284 WeakPolarHBondContact O-CB 3.45Å; F281-Y284 PolarHBondContact O-N 3.29Å; Y284-D286 PolarHBondContact O-N 2.99Å; Y284-D286 VanDerWaalsContact O-N 3.14Å; Y284-I287 PolarHBondContact O-N 3.32Å; Y284-S288 WeakPolarHBondContact O-CB 3.26Å; Y284-S288 PolarHBondContact O-N 3.47Å; Y284-S288 PolarHBondContact O-OG 2.91Å
285	G	94.1	Very high	96.6	Very high	48 Å²	48	43.7 Å²	43.7	50%	0.495	23%	0.229	S	C	.	.	H	α-helix	trans	-59.1	-27.4	-179.5	0	0	0	0	0	113.8	H283 R289	H283-G285 VanDerWaalsContact C-N 3.3Å; H283-G285 PolarHBondContact O-N 3.46Å; G285-R289 WeakPolarHBondContact O-CD 3.33Å; G285-R289 WeakPolarHBondContact O-CG 3.33Å; G285-R289 PolarHBondContact O-NE 3.45Å
286	D	95.5	Very high	96.7	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.027	20%	0.203	C	C	.	.	H	α-helix	trans	-90.3	-48.9	177.4	-70.9	-13.9	0	0	0	112.1	H283 Y284 S288 R289 R413 R416 A417	H283-D286 PolarHBondContact O-N 3.35Å; Y284-D286 PolarHBondContact O-N 2.99Å; Y284-D286 VanDerWaalsContact O-N 3.14Å; D286-S288 VanDerWaalsContact C-N 3.34Å; D286-S288 PolarHBondContact O-N 2.86Å; D286-R289 PolarHBondContact O-N 3.49Å; D286-R289 IonicContact OD1-CZ 3.76Å; D286-R289 IonicContact OD1-NH2 3.92Å; D286-R289 PolarHBondContact OD1-NH2 3.31Å; D286-R413 VanDerWaalsContact CG-NH2 3.26Å; D286-R413 IonicContact OD1-CZ 3.69Å; D286-R413 IonicContact OD1-NH2 3.13Å; D286-R413 PolarHBondContact OD1-NH2 3.07Å; D286-R413 IonicContact OD2-CZ 3.32Å; D286-R413 IonicContact OD2-NH1 2.76Å; D286-R413 PolarHBondContact OD2-NH1 3.39Å; D286-R413 IonicContact OD2-NH2 3.99Å; D286-R413 PolarHBondContact OD2-NH2 3.28Å; D286-R416 HydrophobicContact CB-CB 4.32Å; D286-R416 PolarHBondContact O-NH2 2.93Å; D286-A417 HydrophobicContact CB-CB 3.73Å; D286-A417 PolarHBondContact OD2-N 3.34Å
287	I	95.4	Very high	96.7	Very high	18 Å²	18	39.9 Å²	39.9	9%	0.092	21%	0.212	C	C	.	.	H	α-helix	trans	-79.7	-15.7	-171.7	69.6	-176.1	0	0	0	113.5	F244 H283 Y284 R289 I393 A417 R419	F244-I287 HydrophobicContact CB-CD1 3.63Å; F244-I287 HydrophobicContact CG-CD1 4.46Å; H283-I287 HydrophobicContact CB-CD1 4.43Å; H283-I287 HydrophobicContact CB-CG2 4.1Å; H283-I287 WeakPolarHBondContact O-CG1 3.44Å; H283-I287 PolarHBondContact O-N 2.96Å; Y284-I287 PolarHBondContact O-N 3.32Å; I287-R289 VanDerWaalsContact C-N 3.35Å; I287-I393 HydrophobicContact CD1-CD1 4.44Å; I287-I393 HydrophobicContact CG2-CG2 4.3Å; I287-A417 HydrophobicContact CG2-CB 4Å; I287-R419 HydrophobicContact CB-CG 4.08Å; I287-R419 HydrophobicContact CG2-CG 4.12Å
288	S	94.3	Very high	96.7	Very high	52 Å²	52	39.4 Å²	39.4	36%	0.364	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-21.8	171.4	59.7	0	0	0	0	112.9	Y284 D286	Y284-S288 WeakPolarHBondContact O-CB 3.26Å; Y284-S288 PolarHBondContact O-N 3.47Å; Y284-S288 PolarHBondContact O-OG 2.91Å; D286-S288 VanDerWaalsContact C-N 3.34Å; D286-S288 PolarHBondContact O-N 2.86Å
289	R	94.1	Very high	96.8	Very high	45 Å²	45	34.2 Å²	34.2	17%	0.17	19%	0.186	C	C	.	.	S	Bend	trans	-80.8	141.8	178.2	-67.1	-177.9	-69.4	146.5	-4.8	110.1	G285 D286 I287 Q406 R407 D411 R416	G285-R289 WeakPolarHBondContact O-CD 3.33Å; G285-R289 WeakPolarHBondContact O-CG 3.33Å; G285-R289 PolarHBondContact O-NE 3.45Å; D286-R289 PolarHBondContact O-N 3.49Å; D286-R289 IonicContact OD1-CZ 3.76Å; D286-R289 IonicContact OD1-NH2 3.92Å; D286-R289 PolarHBondContact OD1-NH2 3.31Å; I287-R289 VanDerWaalsContact C-N 3.35Å; R289-Q406 PolarHBondContact NH1-O 2.77Å; R289-R407 VanDerWaalsContact NH1-C 3.25Å; R289-D411 IonicContact NH2-OD2 3.73Å; R289-R416 PolarHBondContact O-NH2 2.76Å
290	A	95.9	Very high	96.8	Very high	37 Å²	37	33.8 Å²	33.8	31%	0.306	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-55.6	145.1	178	0	0	0	0	0	112	F328 G329 Q406 R416	A290-F328 HydrophobicContact CB-CB 4.18Å; A290-F328 HydrophobicContact CB-CD1 4.44Å; A290-G329 CarbonylContact C-O 3.21Å; A290-G329 WeakPolarHBondContact CA-O 3.41Å; A290-Q406 PolarHBondContact O-OE1 2.88Å; A290-R416 PolarHBondContact O-NH1 2.91Å; A290-R416 PolarHBondContact O-NH2 2.77Å
291	V	97.2	Very high	96.8	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.8	170.7	-176	0	0	0	0	107.2	E295 F322 F328 G329 V332 V418	V291-E295 HydrophobicContact CG1-CB 3.76Å; V291-F322 HydrophobicContact CB-CZ 4.1Å; V291-F322 HydrophobicContact CG1-CZ 4.09Å; V291-F322 VanDerWaalsContact O-CZ 3.28Å; V291-F322 WeakPolarHBondContact O-CZ 3.4Å; V291-F328 CarbonylContact O-C 3.26Å; V291-F328 VanDerWaalsContact O-CA 3.22Å; V291-F328 WeakPolarHBondContact O-CA 3.48Å; V291-G329 PolarHBondContact N-O 3.47Å; V291-G329 PolarHBondContact O-N 2.96Å; V291-V332 HydrophobicContact CG1-CG2 3.78Å; V291-V418 HydrophobicContact CG1-CG1 4.18Å; V291-V418 HydrophobicContact CG2-CG1 3.92Å
292	S	97.4	Very high	96.9	Very high	15 Å²	15	37 Å²	37	11%	0.105	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	160.1	175.1	66.1	0	0	0	0	111.9	A294 E295 A296 D327	S292-A294 PolarHBondContact O-N 2.98Å; S292-E295 WeakPolarHBondContact CB-OE2 3.45Å; S292-E295 PolarHBondContact N-OE2 2.82Å; S292-E295 PolarHBondContact O-N 3.12Å; S292-E295 VanDerWaalsContact O-N 3.17Å; S292-E295 VanDerWaalsContact OG-CG 3.29Å; S292-E295 WeakPolarHBondContact OG-CG 3.46Å; S292-E295 PolarHBondContact OG-N 3Å; S292-E295 PolarHBondContact OG-OE2 3.41Å; S292-A296 WeakPolarHBondContact O-CB 3.35Å; S292-A296 PolarHBondContact O-N 3.43Å; S292-D327 CarbonylContact C-O 3.58Å; S292-D327 WeakPolarHBondContact CA-O 2.97Å
293	K	96.7	Very high	96.9	Very high	91 Å²	91	30.8 Å²	30.8	40%	0.396	17%	0.17	S	C	.	.	H	α-helix	trans	-59.3	-29.1	172.9	-171.5	176.7	-179.6	-179.4	0	113.4	R297 F322 D327	K293-R297 WeakPolarHBondContact O-CG 3.43Å; K293-R297 PolarHBondContact O-N 3.16Å; K293-R297 VanDerWaalsContact O-N 3.13Å; K293-R297 PolarHBondContact O-NE 3.17Å; K293-F322 HydrophobicContact CB-CD1 4.26Å; K293-F322 HydrophobicContact CB-CE1 4.37Å; K293-D327 PolarHBondContact N-O 3.02Å
294	A	97.3	Very high	97	Very high	23 Å²	23	32.7 Å²	32.7	19%	0.19	18%	0.181	C	C	.	.	H	α-helix	trans	-70.2	-46.2	174.5	0	0	0	0	0	111.3	S292 A296 R297 A298 V401	S292-A294 PolarHBondContact O-N 2.98Å; A294-A296 VanDerWaalsContact C-N 3.34Å; A294-A296 PolarHBondContact O-N 3.2Å; A294-R297 PolarHBondContact O-N 3.32Å; A294-A298 PolarHBondContact O-N 2.98Å; A294-V401 HydrophobicContact CB-CG1 4Å
295	E	98.2	Very high	97	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-41.9	174.5	-70.7	162.2	140.3	0	0	111.4	V291 S292 R297 A298 V299 L396 V401 L405 Q406 R416	V291-E295 HydrophobicContact CG1-CB 3.76Å; S292-E295 WeakPolarHBondContact CB-OE2 3.45Å; S292-E295 PolarHBondContact N-OE2 2.82Å; S292-E295 PolarHBondContact O-N 3.12Å; S292-E295 VanDerWaalsContact O-N 3.17Å; S292-E295 VanDerWaalsContact OG-CG 3.29Å; S292-E295 WeakPolarHBondContact OG-CG 3.46Å; S292-E295 PolarHBondContact OG-N 3Å; S292-E295 PolarHBondContact OG-OE2 3.41Å; E295-R297 PolarHBondContact O-N 2.84Å; E295-A298 PolarHBondContact O-N 3.21Å; E295-V299 WeakPolarHBondContact O-CG2 3.33Å; E295-V299 PolarHBondContact O-N 3.32Å; E295-L396 HydrophobicContact CB-CD2 3.73Å; E295-L396 HydrophobicContact CG-CD2 3.86Å; E295-V401 HydrophobicContact CG-CG1 3.88Å; E295-V401 HydrophobicContact CG-CG2 4.3Å; E295-L405 HydrophobicContact CG-CD2 4.22Å; E295-Q406 PolarHBondContact OE1-N 2.72Å; E295-R416 VanDerWaalsContact OE1-CD 3.26Å; E295-R416 WeakPolarHBondContact OE1-CD 3.47Å; E295-R416 IonicContact OE1-CZ 2.66Å; E295-R416 IonicContact OE1-NE 3.89Å; E295-R416 IonicContact OE1-NH1 3.42Å; E295-R416 PolarHBondContact OE1-NH1 3.13Å; E295-R416 IonicContact OE2-NH1 3.41Å; E295-R416 PolarHBondContact OE2-NH1 3.45Å
296	A	98.3	Very high	97.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.1	-46.7	175.6	0	0	0	0	0	111.9	S292 A294 V299 G300 F322 V332 Y334	S292-A296 WeakPolarHBondContact O-CB 3.35Å; S292-A296 PolarHBondContact O-N 3.43Å; A294-A296 VanDerWaalsContact C-N 3.34Å; A294-A296 PolarHBondContact O-N 3.2Å; A296-V299 PolarHBondContact O-N 3.37Å; A296-G300 PolarHBondContact O-N 2.88Å; A296-F322 HydrophobicContact CB-CD1 4.14Å; A296-F322 HydrophobicContact CB-CD2 3.86Å; A296-F322 HydrophobicContact CB-CE1 4.05Å; A296-F322 HydrophobicContact CB-CE2 3.73Å; A296-F322 HydrophobicContact CB-CG 4.05Å; A296-F322 HydrophobicContact CB-CZ 3.83Å; A296-V332 HydrophobicContact CB-CG1 3.79Å; A296-V332 HydrophobicContact CB-CG2 4Å; A296-Y334 PolarHBondContact O-OH 3.37Å
297	R	98.2	Very high	97.2	Very high	121 Å²	121	32.3 Å²	32.3	46%	0.457	17%	0.168	S	C	.	.	H	α-helix	trans	-62	-43.5	175.8	-77.4	-175.2	-76.1	167.7	4.4	112.4	K293 A294 E295 V299 G300 N301 E402	K293-R297 WeakPolarHBondContact O-CG 3.43Å; K293-R297 PolarHBondContact O-N 3.16Å; K293-R297 VanDerWaalsContact O-N 3.13Å; K293-R297 PolarHBondContact O-NE 3.17Å; A294-R297 PolarHBondContact O-N 3.32Å; E295-R297 PolarHBondContact O-N 2.84Å; R297-V299 VanDerWaalsContact C-N 3.34Å; R297-V299 PolarHBondContact O-N 2.74Å; R297-G300 WeakPolarHBondContact O-CA 3.2Å; R297-G300 PolarHBondContact O-N 3.27Å; R297-N301 PolarHBondContact O-N 3.29Å; R297-N301 PolarHBondContact O-OD1 2.95Å; R297-E402 IonicContact NH2-OE2 3.62Å
298	A	98.4	Very high	97.3	Very high	5 Å²	5	34.9 Å²	34.9	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-40.2	177.9	0	0	0	0	0	112.6	A294 E295 G300 N301 I302 L396 R400 V401	A294-A298 PolarHBondContact O-N 2.98Å; E295-A298 PolarHBondContact O-N 3.21Å; A298-G300 VanDerWaalsContact C-N 3.31Å; A298-N301 PolarHBondContact O-N 3.38Å; A298-I302 WeakPolarHBondContact O-CG1 3.39Å; A298-I302 PolarHBondContact O-N 3.29Å; A298-L396 HydrophobicContact CB-CD1 3.95Å; A298-R400 VanDerWaalsContact CB-O 3.22Å; A298-R400 WeakPolarHBondContact CB-O 3.05Å; A298-V401 HydrophobicContact CB-CG2 3.8Å
299	V	98.4	Very high	97.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-42.3	170.6	166.2	0	0	0	0	111.1	E295 A296 R297 N301 I302 I303 Y334 L394 L396 V418 V420	E295-V299 WeakPolarHBondContact O-CG2 3.33Å; E295-V299 PolarHBondContact O-N 3.32Å; A296-V299 PolarHBondContact O-N 3.37Å; R297-V299 VanDerWaalsContact C-N 3.34Å; R297-V299 PolarHBondContact O-N 2.74Å; V299-N301 PolarHBondContact O-N 3.31Å; V299-I302 WeakPolarHBondContact O-CB 3.32Å; V299-I302 PolarHBondContact O-N 3.28Å; V299-I303 HydrophobicContact CG1-CD1 3.78Å; V299-I303 WeakPolarHBondContact O-CG1 3.18Å; V299-I303 PolarHBondContact O-N 3.05Å; V299-I303 VanDerWaalsContact O-N 3.15Å; V299-Y334 HydrophobicContact CG1-CE2 4.03Å; V299-L394 HydrophobicContact CG1-CD1 4.29Å; V299-L396 HydrophobicContact CG2-CD1 4.25Å; V299-L396 HydrophobicContact CG2-CD2 4.14Å; V299-V418 HydrophobicContact CG2-CB 4.42Å; V299-V418 HydrophobicContact CG2-CG1 4.12Å; V299-V420 HydrophobicContact CG1-CG1 4.17Å; V299-V420 HydrophobicContact CG1-CG2 3.53Å
300	G	98.3	Very high	97.3	Very high	6 Å²	6	39.2 Å²	39.2	6%	0.062	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-48.7	175.7	0	0	0	0	0	112.1	A296 R297 A298 I302 I303 D304 L316 Y334	A296-G300 PolarHBondContact O-N 2.88Å; R297-G300 WeakPolarHBondContact O-CA 3.2Å; R297-G300 PolarHBondContact O-N 3.27Å; A298-G300 VanDerWaalsContact C-N 3.31Å; G300-I302 VanDerWaalsContact C-N 3.32Å; G300-I302 PolarHBondContact O-N 3.26Å; G300-I303 PolarHBondContact O-N 3.39Å; G300-I303 VanDerWaalsContact O-N 3.14Å; G300-D304 VanDerWaalsContact O-CB 3.29Å; G300-D304 WeakPolarHBondContact O-CB 3.45Å; G300-D304 PolarHBondContact O-N 3.45Å; G300-L316 WeakPolarHBondContact O-CD2 3.49Å; G300-Y334 VanDerWaalsContact CA-CZ 3.4Å; G300-Y334 WeakPolarHBondContact CA-OH 3.36Å; G300-Y334 PolarHBondContact N-OH 3.08Å; G300-Y334 VanDerWaalsContact N-OH 3.16Å
301	N	98.4	Very high	97.2	Very high	98 Å²	98	38.1 Å²	38.1	52%	0.524	20%	0.195	S	C	.	.	H	α-helix	trans	-59.4	-40.8	178.3	-63.9	-7	0	0	0	112.6	R297 A298 V299 I303 D304 E305	R297-N301 PolarHBondContact O-N 3.29Å; R297-N301 PolarHBondContact O-OD1 2.95Å; A298-N301 PolarHBondContact O-N 3.38Å; V299-N301 PolarHBondContact O-N 3.31Å; N301-I303 VanDerWaalsContact C-N 3.31Å; N301-I303 PolarHBondContact O-N 3.47Å; N301-D304 PolarHBondContact O-N 3.35Å; N301-E305 WeakPolarHBondContact O-CB 3.45Å; N301-E305 VanDerWaalsContact O-CG 3.25Å; N301-E305 WeakPolarHBondContact O-CG 3.46Å; N301-E305 PolarHBondContact O-N 2.95Å
302	I	98.2	Very high	97.1	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-43.4	176.6	-70	165	0	0	0	111.2	A298 V299 G300 A306 L355 L360 L396	A298-I302 WeakPolarHBondContact O-CG1 3.39Å; A298-I302 PolarHBondContact O-N 3.29Å; V299-I302 WeakPolarHBondContact O-CB 3.32Å; V299-I302 PolarHBondContact O-N 3.28Å; G300-I302 VanDerWaalsContact C-N 3.32Å; G300-I302 PolarHBondContact O-N 3.26Å; I302-A306 WeakPolarHBondContact O-CB 3.47Å; I302-A306 PolarHBondContact O-N 3.1Å; I302-A306 VanDerWaalsContact O-N 3.1Å; I302-L355 HydrophobicContact CG2-CD2 3.64Å; I302-L360 HydrophobicContact CG2-CD1 3.65Å; I302-L396 HydrophobicContact CD1-CD1 3.85Å
303	I	98.2	Very high	96.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-74.6	-37	-177.8	-61.2	170.5	0	0	0	110.2	V299 G300 N301 A306 V307 L316 Y334 L394 V420 L422	V299-I303 HydrophobicContact CG1-CD1 3.78Å; V299-I303 WeakPolarHBondContact O-CG1 3.18Å; V299-I303 PolarHBondContact O-N 3.05Å; V299-I303 VanDerWaalsContact O-N 3.15Å; G300-I303 PolarHBondContact O-N 3.39Å; G300-I303 VanDerWaalsContact O-N 3.14Å; N301-I303 VanDerWaalsContact C-N 3.31Å; N301-I303 PolarHBondContact O-N 3.47Å; I303-A306 PolarHBondContact O-N 3.29Å; I303-V307 WeakPolarHBondContact O-CB 3.3Å; I303-V307 WeakPolarHBondContact O-CG1 3.33Å; I303-V307 PolarHBondContact O-N 3.37Å; I303-L316 HydrophobicContact CB-CD2 4.06Å; I303-L316 HydrophobicContact CG2-CD1 3.89Å; I303-L316 HydrophobicContact CG2-CD2 4.04Å; I303-Y334 HydrophobicContact CD1-CD2 4.14Å; I303-Y334 HydrophobicContact CD1-CE2 4.32Å; I303-L394 HydrophobicContact CD1-CD1 4.24Å; I303-L394 HydrophobicContact CG1-CD1 4.33Å; I303-V420 HydrophobicContact CD1-CG1 3.72Å; I303-L422 HydrophobicContact CD1-CD2 4Å; I303-L422 HydrophobicContact CG2-CD1 4.42Å; I303-L422 HydrophobicContact CG2-CD2 4.47Å
304	D	98.2	Very high	96.8	Very high	61 Å²	61	42.1 Å²	42.1	33%	0.326	23%	0.227	S	C	.	.	H	α-helix	trans	-61.2	-48.7	175.4	-162.4	70.6	0	0	0	111.4	G300 N301 A306 V307 H308 L316	G300-D304 VanDerWaalsContact O-CB 3.29Å; G300-D304 WeakPolarHBondContact O-CB 3.45Å; G300-D304 PolarHBondContact O-N 3.45Å; N301-D304 PolarHBondContact O-N 3.35Å; D304-A306 VanDerWaalsContact C-N 3.33Å; D304-A306 PolarHBondContact O-N 2.88Å; D304-V307 WeakPolarHBondContact O-CG1 3.4Å; D304-V307 PolarHBondContact O-N 3.16Å; D304-H308 WeakPolarHBondContact O-CB 3.44Å; D304-H308 PolarHBondContact O-N 3.4Å; D304-H308 PolarHBondContact O-ND1 3.24Å; D304-H308 IonicContact OD1-CE1 3.3Å; D304-H308 PolarHBondContact OD1-CE1 2.72Å; D304-H308 IonicContact OD1-ND1 3.1Å; D304-H308 PolarHBondContact OD1-ND1 3.35Å; D304-H308 IonicContact OD2-CE1 2.64Å; D304-H308 IonicContact OD2-ND1 3.53Å; D304-H308 PolarHBondContact OD2-ND1 3.36Å; D304-L316 HydrophobicContact CB-CD2 3.82Å
305	E	96.9	Very high	96.8	Very high	101 Å²	101	44.3 Å²	44.3	47%	0.472	24%	0.235	S	C	.	.	H	α-helix	trans	-57	-46.4	172.8	-74.6	167	-165.8	0	0	111	N301 V309 R400	N301-E305 WeakPolarHBondContact O-CB 3.45Å; N301-E305 VanDerWaalsContact O-CG 3.25Å; N301-E305 WeakPolarHBondContact O-CG 3.46Å; N301-E305 PolarHBondContact O-N 2.95Å; E305-V309 WeakPolarHBondContact O-CG2 3.35Å; E305-V309 PolarHBondContact O-N 3.49Å; E305-R400 IonicContact OE2-NH1 2.9Å; E305-R400 PolarHBondContact OE2-NH1 3.13Å
306	A	96.8	Very high	96.8	Very high	1 Å²	1	46 Å²	46	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-39.5	-178.6	0	0	0	0	0	112.9	I302 I303 D304 I310 L355	I302-A306 WeakPolarHBondContact O-CB 3.47Å; I302-A306 PolarHBondContact O-N 3.1Å; I302-A306 VanDerWaalsContact O-N 3.1Å; I303-A306 PolarHBondContact O-N 3.29Å; D304-A306 VanDerWaalsContact C-N 3.33Å; D304-A306 PolarHBondContact O-N 2.88Å; A306-I310 WeakPolarHBondContact O-CD1 3.41Å; A306-L355 HydrophobicContact CB-CD2 4.14Å; A306-L355 HydrophobicContact CB-CG 4.49Å
307	V	97.1	Very high	96.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-77.1	-35.1	-177.4	74.8	0	0	0	0	112.5	I303 D304 V309 I310 T311 A314 V336 L347 I351	I303-V307 WeakPolarHBondContact O-CB 3.3Å; I303-V307 WeakPolarHBondContact O-CG1 3.33Å; I303-V307 PolarHBondContact O-N 3.37Å; D304-V307 WeakPolarHBondContact O-CG1 3.4Å; D304-V307 PolarHBondContact O-N 3.16Å; V307-V309 VanDerWaalsContact C-N 3.29Å; V307-V309 PolarHBondContact O-N 3Å; V307-I310 WeakPolarHBondContact O-CA 3.47Å; V307-I310 WeakPolarHBondContact O-CB 3.44Å; V307-I310 PolarHBondContact O-N 3.35Å; V307-T311 HydrophobicContact CG2-CG2 4.5Å; V307-T311 PolarHBondContact O-N 3.43Å; V307-A314 HydrophobicContact CB-CB 4.22Å; V307-A314 HydrophobicContact CG1-CB 3.61Å; V307-A314 HydrophobicContact CG2-CB 3.66Å; V307-V336 HydrophobicContact CB-CG2 4.45Å; V307-V336 HydrophobicContact CG2-CG2 3.83Å; V307-L347 HydrophobicContact CG2-CD1 3.71Å; V307-L347 HydrophobicContact CG2-CD2 4.25Å; V307-L347 HydrophobicContact CG2-CG 4.16Å; V307-I351 HydrophobicContact CB-CD1 4.09Å; V307-I351 HydrophobicContact CB-CG1 4.19Å; V307-I351 HydrophobicContact CG2-CD1 3.85Å; V307-I351 HydrophobicContact CG2-CG1 4.18Å
308	H	96.6	Very high	96.9	Very high	72 Å²	72	43.3 Å²	43.3	33%	0.333	24%	0.241	S	C	.	.	H	α-helix	trans	-71.6	-21.7	179.6	-75.9	93.3	0	0	0	113.7	D304 I310 T311	D304-H308 WeakPolarHBondContact O-CB 3.44Å; D304-H308 PolarHBondContact O-N 3.4Å; D304-H308 PolarHBondContact O-ND1 3.24Å; D304-H308 IonicContact OD1-CE1 3.3Å; D304-H308 PolarHBondContact OD1-CE1 2.72Å; D304-H308 IonicContact OD1-ND1 3.1Å; D304-H308 PolarHBondContact OD1-ND1 3.35Å; D304-H308 IonicContact OD2-CE1 2.64Å; D304-H308 IonicContact OD2-ND1 3.53Å; D304-H308 PolarHBondContact OD2-ND1 3.36Å; H308-I310 PolarHBondContact O-N 3.3Å; H308-T311 WeakPolarHBondContact CA-O 3.1Å
309	V	94.1	Very high	96.8	Very high	123 Å²	123	43.1 Å²	43.1	75%	0.745	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-28.7	167.3	172.9	0	0	0	0	111.6	E305 V307	E305-V309 WeakPolarHBondContact O-CG2 3.35Å; E305-V309 PolarHBondContact O-N 3.49Å; V307-V309 VanDerWaalsContact C-N 3.29Å; V307-V309 PolarHBondContact O-N 3Å
310	I	94.2	Very high	96.8	Very high	65 Å²	65	43.2 Å²	43.2	33%	0.333	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-46.9	-177.7	-60.6	157.6	0	0	0	110.6	A306 V307 H308 L347 S350 I351	A306-I310 WeakPolarHBondContact O-CD1 3.41Å; V307-I310 WeakPolarHBondContact O-CA 3.47Å; V307-I310 WeakPolarHBondContact O-CB 3.44Å; V307-I310 PolarHBondContact O-N 3.35Å; H308-I310 PolarHBondContact O-N 3.3Å; I310-L347 HydrophobicContact CG2-CD1 4.02Å; I310-S350 VanDerWaalsContact CD1-C 3.46Å; I310-S350 VanDerWaalsContact CD1-CB 3.49Å; I310-I351 HydrophobicContact CD1-CG1 3.83Å
311	T	94.7	Very high	96.8	Very high	14 Å²	14	43.4 Å²	43.4	9%	0.086	24%	0.243	C	C	.	.			trans	-144.9	122.9	178.1	-179.1	0	0	0	0	110.6	V307 H308 N313 A314 T338 L347	V307-T311 HydrophobicContact CG2-CG2 4.5Å; V307-T311 PolarHBondContact O-N 3.43Å; H308-T311 WeakPolarHBondContact CA-O 3.1Å; T311-N313 PolarHBondContact O-N 3.45Å; T311-A314 HydrophobicContact CG2-CB 3.86Å; T311-A314 WeakPolarHBondContact O-CB 3.5Å; T311-A314 PolarHBondContact O-N 3.02Å; T311-T338 PolarHBondContact OG1-OG1 3.41Å; T311-L347 HydrophobicContact CG2-CD1 3.99Å
312	P	93.8	Very high	96.8	Very high	103 Å²	103	39.2 Å²	39.2	67%	0.669	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.5	179.9	28.8	-35.5	0	0	0	113	A314	P312-A314 VanDerWaalsContact C-N 3.34Å
313	N	93.6	Very high	96.8	Very high	77 Å²	77	45.7 Å²	45.7	41%	0.412	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	22.9	179	-58.6	-37.2	0	0	0	112.3	T311 T339	T311-N313 PolarHBondContact O-N 3.45Å; N313-T339 HydrophobicContact CB-CG2 4.49Å; N313-T339 WeakPolarHBondContact CB-OG1 3.49Å; N313-T339 PolarHBondContact O-N 3Å
314	A	96.1	Very high	96.7	Very high	13 Å²	13	50.1 Å²	50.1	11%	0.107	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	146.7	178.5	0	0	0	0	0	111.1	V307 T311 P312 T337	V307-A314 HydrophobicContact CB-CB 4.22Å; V307-A314 HydrophobicContact CG1-CB 3.61Å; V307-A314 HydrophobicContact CG2-CB 3.66Å; T311-A314 HydrophobicContact CG2-CB 3.86Å; T311-A314 WeakPolarHBondContact O-CB 3.5Å; T311-A314 PolarHBondContact O-N 3.02Å; P312-A314 VanDerWaalsContact C-N 3.34Å; A314-T337 CarbonylContact C-O 3.59Å; A314-T337 WeakPolarHBondContact CA-O 3.26Å
315	I	97.1	Very high	96.7	Very high	68 Å²	68	48.9 Å²	48.9	35%	0.349	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	115.2	170.3	-59.1	173	0	0	0	106.7	V336 T337 T339 F430	I315-V336 CarbonylContact O-C 3.55Å; I315-V336 VanDerWaalsContact O-CA 3.3Å; I315-V336 WeakPolarHBondContact O-CA 3.44Å; I315-T337 HydrophobicContact CB-CG2 3.96Å; I315-T337 HydrophobicContact CD1-CG2 4.37Å; I315-T337 PolarHBondContact N-O 2.98Å; I315-T337 PolarHBondContact O-N 2.77Å; I315-T339 HydrophobicContact CD1-CG2 4.08Å; I315-F430 HydrophobicContact CG2-CE2 3.94Å; I315-F430 HydrophobicContact CG2-CZ 3.81Å
316	L	98.1	Very high	96.6	Very high	35 Å²	35	48.3 Å²	48.3	18%	0.183	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.2	173.1	-175.9	68.8	0	0	0	109.7	G300 I303 D304 Y334 V336	G300-L316 WeakPolarHBondContact O-CD2 3.49Å; I303-L316 HydrophobicContact CB-CD2 4.06Å; I303-L316 HydrophobicContact CG2-CD1 3.89Å; I303-L316 HydrophobicContact CG2-CD2 4.04Å; D304-L316 HydrophobicContact CB-CD2 3.82Å; L316-Y334 HydrophobicContact CD1-CD1 3.76Å; L316-Y334 HydrophobicContact CD1-CG 3.98Å; L316-Y334 HydrophobicContact CD2-CD1 4.21Å; L316-Y334 HydrophobicContact CD2-CE1 4.37Å; L316-Y334 HydrophobicContact CG-CD1 3.8Å; L316-Y334 HydrophobicContact CG-CE1 4.34Å; L316-V336 HydrophobicContact CD1-CB 3.85Å; L316-V336 HydrophobicContact CD1-CG2 4.1Å
317	A	98.3	Very high	96.6	Very high	18 Å²	18	53 Å²	53	15%	0.149	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.4	-179	0	0	0	0	0	111.5	T319 Y334 V335 F430 M434	A317-T319 PolarHBondContact O-N 2.81Å; A317-Y334 WeakPolarHBondContact O-CA 3.38Å; A317-V335 PolarHBondContact N-O 3.32Å; A317-V335 PolarHBondContact O-N 3.43Å; A317-F430 HydrophobicContact CB-CZ 3.93Å; A317-M434 HydrophobicContact CB-CE 3.84Å; A317-M434 HydrophobicContact CB-SD 3.62Å
318	L	98.6	Very high	96.6	Very high	48 Å²	48	58 Å²	58	25%	0.251	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	130	170.3	179.6	64.4	0	0	0	109.6	F322 R323 V332 Y334	L318-F322 HydrophobicContact CD1-CB 4.15Å; L318-F322 HydrophobicContact CD1-CD2 4.49Å; L318-F322 HydrophobicContact CD2-CB 3.77Å; L318-F322 HydrophobicContact CG-CB 4.11Å; L318-R323 VanDerWaalsContact O-CD 3.26Å; L318-R323 WeakPolarHBondContact O-CD 3.39Å; L318-V332 HydrophobicContact CD1-CG1 3.61Å; L318-Y334 HydrophobicContact CB-CD1 4.17Å; L318-Y334 HydrophobicContact CB-CE1 3.69Å; L318-Y334 HydrophobicContact CD1-CD1 4.4Å; L318-Y334 HydrophobicContact CD1-CE1 3.8Å; L318-Y334 HydrophobicContact CD1-CE2 4.2Å; L318-Y334 HydrophobicContact CG-CE1 4.34Å
319	T	98.3	Very high	96.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.			trans	-122.9	-150.1	-179.2	64.9	0	0	0	0	111.7	A317 R323 D333 V335 M434 W437	A317-T319 PolarHBondContact O-N 2.81Å; T319-R323 WeakPolarHBondContact O-CB 3.21Å; T319-R323 PolarHBondContact O-N 3.01Å; T319-R323 VanDerWaalsContact O-N 3.12Å; T319-D333 PolarHBondContact N-O 2.82Å; T319-D333 VanDerWaalsContact OG1-CB 3.26Å; T319-D333 WeakPolarHBondContact OG1-CB 3.35Å; T319-D333 PolarHBondContact OG1-O 3.4Å; T319-D333 VanDerWaalsContact OG1-O 3.06Å; T319-V335 HydrophobicContact CG2-CB 4.24Å; T319-V335 HydrophobicContact CG2-CG2 3.55Å; T319-M434 HydrophobicContact CG2-CE 3.82Å; T319-M434 HydrophobicContact CG2-SD 3.55Å; T319-M434 VanDerWaalsContact CG2-SD 3.55Å; T319-W437 HydrophobicContact CG2-CB 4.24Å
320	G	97.7	Very high	96.6	Very high	2 Å²	2	55.7 Å²	55.7	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	59.9	-148.8	171.2	0	0	0	0	0	115.1	F322 R324 D333 W437	G320-F322 PolarHBondContact O-N 2.81Å; G320-R324 WeakPolarHBondContact O-CG 3.28Å; G320-R324 PolarHBondContact O-N 3.28Å; G320-R324 PolarHBondContact O-NH1 3.08Å; G320-R324 VanDerWaalsContact O-NH1 3.16Å; G320-D333 VanDerWaalsContact CA-OD2 3.31Å; G320-D333 WeakPolarHBondContact CA-OD2 3.36Å; G320-W437 WeakPolarHBondContact CA-O 3.3Å; G320-W437 PolarHBondContact N-O 2.88Å
321	G	97.3	Very high	96.7	Very high	11 Å²	11	54.4 Å²	54.4	11%	0.113	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-39.8	-178.3	0	0	0	0	0	114	R324 G325 K326	G321-R324 PolarHBondContact O-N 2.79Å; G321-G325 PolarHBondContact O-N 2.84Å; G321-K326 WeakPolarHBondContact O-CB 3.4Å; G321-K326 PolarHBondContact O-N 3.01Å; G321-K326 VanDerWaalsContact O-N 3.11Å
322	F	98.2	Very high	96.9	Very high	9 Å²	9	53.7 Å²	53.7	4%	0.039	28%	0.279	C	S	.	.	H	α-helix	trans	-68.3	-39.5	-177.1	-66.7	-71.4	0	0	0	112.3	V291 K293 A296 L318 G320 R324 G325 K326 D331 V332	V291-F322 HydrophobicContact CB-CZ 4.1Å; V291-F322 HydrophobicContact CG1-CZ 4.09Å; V291-F322 VanDerWaalsContact O-CZ 3.28Å; V291-F322 WeakPolarHBondContact O-CZ 3.4Å; K293-F322 HydrophobicContact CB-CD1 4.26Å; K293-F322 HydrophobicContact CB-CE1 4.37Å; A296-F322 HydrophobicContact CB-CD1 4.14Å; A296-F322 HydrophobicContact CB-CD2 3.86Å; A296-F322 HydrophobicContact CB-CE1 4.05Å; A296-F322 HydrophobicContact CB-CE2 3.73Å; A296-F322 HydrophobicContact CB-CG 4.05Å; A296-F322 HydrophobicContact CB-CZ 3.83Å; L318-F322 HydrophobicContact CD1-CB 4.15Å; L318-F322 HydrophobicContact CD1-CD2 4.49Å; L318-F322 HydrophobicContact CD2-CB 3.77Å; L318-F322 HydrophobicContact CG-CB 4.11Å; G320-F322 PolarHBondContact O-N 2.81Å; F322-R324 PolarHBondContact O-N 3.36Å; F322-G325 PolarHBondContact O-N 2.86Å; F322-K326 VanDerWaalsContact CD1-O 3.27Å; F322-K326 WeakPolarHBondContact CD1-O 3.32Å; F322-D331 VanDerWaalsContact CE2-O 3.26Å; F322-D331 WeakPolarHBondContact CE2-O 3.49Å; F322-V332 HydrophobicContact CD2-CG1 4.25Å; F322-V332 HydrophobicContact CE2-CG1 4.37Å; F322-V332 HydrophobicContact CE2-CG2 4.09Å
323	R	98.1	Very high	97.1	Very high	138 Å²	138	49.9 Å²	49.9	52%	0.521	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-30.7	173.9	-167.5	-178.6	-175	-98.9	-7.8	112.5	L318 T319 G325 T438	L318-R323 VanDerWaalsContact O-CD 3.26Å; L318-R323 WeakPolarHBondContact O-CD 3.39Å; T319-R323 WeakPolarHBondContact O-CB 3.21Å; T319-R323 PolarHBondContact O-N 3.01Å; T319-R323 VanDerWaalsContact O-N 3.12Å; R323-G325 PolarHBondContact O-N 3.24Å; R323-T438 WeakPolarHBondContact CD-OG1 3.3Å; R323-T438 PolarHBondContact NH1-OG1 3.29Å
324	R	97.7	Very high	97.4	Very high	93 Å²	93	46.6 Å²	46.6	35%	0.351	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	1.7	174.3	-59.4	-170.2	-53.8	-88.8	0.1	113.9	I149 G320 G321 F322 T438	I149-R324 WeakPolarHBondContact CD1-O 3.42Å; G320-R324 WeakPolarHBondContact O-CG 3.28Å; G320-R324 PolarHBondContact O-N 3.28Å; G320-R324 PolarHBondContact O-NH1 3.08Å; G320-R324 VanDerWaalsContact O-NH1 3.16Å; G321-R324 PolarHBondContact O-N 2.79Å; F322-R324 PolarHBondContact O-N 3.36Å; R324-T438 VanDerWaalsContact CD-O 3.24Å; R324-T438 WeakPolarHBondContact CD-O 3.37Å; R324-T438 HydrophobicContact CG-CG2 4Å; R324-T438 WeakPolarHBondContact CG-O 3.4Å; R324-T438 PolarHBondContact NH1-O 3.49Å
325	G	96.6	Very high	97.5	Very high	36 Å²	36	46 Å²	46	37%	0.371	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	15.6	176.3	0	0	0	0	0	115.1	G321 F322 R323	G321-G325 PolarHBondContact O-N 2.84Å; F322-G325 PolarHBondContact O-N 2.86Å; R323-G325 PolarHBondContact O-N 3.24Å
326	K	96.6	Very high	97.5	Very high	89 Å²	89	42.8 Å²	42.8	39%	0.387	21%	0.213	S	C	.	.			trans	-69	136	169.9	-72.4	-173.8	142.4	-161.4	0	110.6	I149 G321 F322 F328	I149-K326 HydrophobicContact CD1-CG 3.99Å; G321-K326 WeakPolarHBondContact O-CB 3.4Å; G321-K326 PolarHBondContact O-N 3.01Å; G321-K326 VanDerWaalsContact O-N 3.11Å; F322-K326 VanDerWaalsContact CD1-O 3.27Å; F322-K326 WeakPolarHBondContact CD1-O 3.32Å; K326-F328 VanDerWaalsContact C-N 3.33Å
327	D	96	Very high	97.5	Very high	98 Å²	98	41.1 Å²	41.1	52%	0.524	21%	0.205	S	C	.	.	S	Bend	trans	-78.1	-23.6	171.2	-63.9	-44.2	0	0	0	112.7	S292 K293	S292-D327 CarbonylContact C-O 3.58Å; S292-D327 WeakPolarHBondContact CA-O 2.97Å; K293-D327 PolarHBondContact N-O 3.02Å
328	F	97	Very high	97.3	Very high	105 Å²	105	40.3 Å²	40.3	46%	0.461	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138.6	-178.7	-59.2	-70.5	0	0	0	112.4	A290 V291 K326	A290-F328 HydrophobicContact CB-CB 4.18Å; A290-F328 HydrophobicContact CB-CD1 4.44Å; V291-F328 CarbonylContact O-C 3.26Å; V291-F328 VanDerWaalsContact O-CA 3.22Å; V291-F328 WeakPolarHBondContact O-CA 3.48Å; K326-F328 VanDerWaalsContact C-N 3.33Å
329	G	95.8	Very high	97	Very high	12 Å²	12	41.9 Å²	41.9	12%	0.124	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	173.2	178.1	0	0	0	0	0	112.3	A290 V291	A290-G329 CarbonylContact C-O 3.21Å; A290-G329 WeakPolarHBondContact CA-O 3.41Å; V291-G329 PolarHBondContact N-O 3.47Å; V291-G329 PolarHBondContact O-N 2.96Å
330	H	94.3	Very high	96.7	Very high	135 Å²	135	45.5 Å²	45.5	63%	0.625	23%	0.226	S	C	*	.	S	Bend	trans	-89.9	-30.3	173.2	-65.9	-69.4	0	0	0	111.8
331	D	96.9	Very high	96.3	Very high	38 Å²	38	50.9 Å²	50.9	20%	0.203	25%	0.254	C	S	.	.	S	Bend	trans	-147.6	171.5	-175.8	40.4	19.5	0	0	0	109.4	F322 R419	F322-D331 VanDerWaalsContact CE2-O 3.26Å; F322-D331 WeakPolarHBondContact CE2-O 3.49Å; D331-R419 WeakPolarHBondContact CA-O 3.3Å; D331-R419 HydrophobicContact CB-CB 3.77Å; D331-R419 IonicContact OD2-CZ 2.92Å; D331-R419 IonicContact OD2-NH2 2.72Å; D331-R419 PolarHBondContact OD2-NH2 3.23Å
332	V	98.4	Very high	96	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.4	177.1	-160.5	0	0	0	0	109.8	V291 A296 L318 F322 Y334 V418 R419 V420 D421	V291-V332 HydrophobicContact CG1-CG2 3.78Å; A296-V332 HydrophobicContact CB-CG1 3.79Å; A296-V332 HydrophobicContact CB-CG2 4Å; L318-V332 HydrophobicContact CD1-CG1 3.61Å; F322-V332 HydrophobicContact CD2-CG1 4.25Å; F322-V332 HydrophobicContact CE2-CG1 4.37Å; F322-V332 HydrophobicContact CE2-CG2 4.09Å; V332-Y334 HydrophobicContact CB-CE2 4.12Å; V332-Y334 HydrophobicContact CG1-CD2 4.03Å; V332-Y334 HydrophobicContact CG1-CE2 3.27Å; V332-V418 HydrophobicContact CG2-CG1 4.02Å; V332-R419 PolarHBondContact N-O 3.24Å; V332-V420 VanDerWaalsContact O-CA 3.3Å; V332-V420 WeakPolarHBondContact O-CA 3.32Å; V332-V420 WeakPolarHBondContact O-CG1 3.46Å; V332-D421 PolarHBondContact O-N 3.45Å
333	D	98.6	Very high	95.6	Very high	23 Å²	23	56.9 Å²	56.9	12%	0.123	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	128.4	-177	-51.2	-64.4	0	0	0	111	T319 G320 D421 W437	T319-D333 PolarHBondContact N-O 2.82Å; T319-D333 VanDerWaalsContact OG1-CB 3.26Å; T319-D333 WeakPolarHBondContact OG1-CB 3.35Å; T319-D333 PolarHBondContact OG1-O 3.4Å; T319-D333 VanDerWaalsContact OG1-O 3.06Å; G320-D333 VanDerWaalsContact CA-OD2 3.31Å; G320-D333 WeakPolarHBondContact CA-OD2 3.36Å; D333-D421 WeakPolarHBondContact CA-O 3.46Å; D333-W437 HydrophobicContact CB-CE3 4.26Å
334	Y	98.7	Very high	95.4	Very high	8 Å²	8	50.9 Å²	50.9	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.4	173.7	-69.3	-89.1	0	0	0	112.5	A296 V299 G300 I303 L316 A317 L318 V332 V420 D421 L422 V423	A296-Y334 PolarHBondContact O-OH 3.37Å; V299-Y334 HydrophobicContact CG1-CE2 4.03Å; G300-Y334 VanDerWaalsContact CA-CZ 3.4Å; G300-Y334 WeakPolarHBondContact CA-OH 3.36Å; G300-Y334 PolarHBondContact N-OH 3.08Å; G300-Y334 VanDerWaalsContact N-OH 3.16Å; I303-Y334 HydrophobicContact CD1-CD2 4.14Å; I303-Y334 HydrophobicContact CD1-CE2 4.32Å; L316-Y334 HydrophobicContact CD1-CD1 3.76Å; L316-Y334 HydrophobicContact CD1-CG 3.98Å; L316-Y334 HydrophobicContact CD2-CD1 4.21Å; L316-Y334 HydrophobicContact CD2-CE1 4.37Å; L316-Y334 HydrophobicContact CG-CD1 3.8Å; L316-Y334 HydrophobicContact CG-CE1 4.34Å; A317-Y334 WeakPolarHBondContact O-CA 3.38Å; L318-Y334 HydrophobicContact CB-CD1 4.17Å; L318-Y334 HydrophobicContact CB-CE1 3.69Å; L318-Y334 HydrophobicContact CD1-CD1 4.4Å; L318-Y334 HydrophobicContact CD1-CE1 3.8Å; L318-Y334 HydrophobicContact CD1-CE2 4.2Å; L318-Y334 HydrophobicContact CG-CE1 4.34Å; V332-Y334 HydrophobicContact CB-CE2 4.12Å; V332-Y334 HydrophobicContact CG1-CD2 4.03Å; V332-Y334 HydrophobicContact CG1-CE2 3.27Å; Y334-V420 HydrophobicContact CD2-CG1 4.2Å; Y334-D421 PolarHBondContact N-O 2.77Å; Y334-L422 HydrophobicContact CD2-CD2 4.29Å; Y334-L422 HydrophobicContact CG-CD2 4.35Å; Y334-L422 WeakPolarHBondContact O-CA 3.5Å; Y334-V423 PolarHBondContact O-N 2.99Å
335	V	98.5	Very high	95.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128	160.9	178.4	0	0	0	0	107	A317 T319 V423 P425 F430 T433 M434 W437	A317-V335 PolarHBondContact N-O 3.32Å; A317-V335 PolarHBondContact O-N 3.43Å; T319-V335 HydrophobicContact CG2-CB 4.24Å; T319-V335 HydrophobicContact CG2-CG2 3.55Å; V335-V423 HydrophobicContact CB-CG1 4.14Å; V335-V423 HydrophobicContact CG1-CG1 4.33Å; V335-V423 HydrophobicContact CG2-CG1 3.57Å; V335-P425 HydrophobicContact CG1-CG 3.7Å; V335-F430 HydrophobicContact CB-CE2 4.3Å; V335-F430 HydrophobicContact CG1-CD2 3.75Å; V335-F430 HydrophobicContact CG1-CE2 3.54Å; V335-T433 HydrophobicContact CG1-CG2 4.27Å; V335-T433 HydrophobicContact CG2-CG2 4.02Å; V335-M434 HydrophobicContact CB-SD 3.83Å; V335-M434 HydrophobicContact CG1-SD 4.34Å; V335-M434 HydrophobicContact CG2-SD 3.76Å; V335-W437 HydrophobicContact CG2-CB 4.09Å; V335-W437 HydrophobicContact CG2-CG 4.35Å
336	V	98.1	Very high	94.9	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.4	176.9	62.8	0	0	0	0	109.5	V307 I315 L316 L347 L348 I351 V423 S424	V307-V336 HydrophobicContact CB-CG2 4.45Å; V307-V336 HydrophobicContact CG2-CG2 3.83Å; I315-V336 CarbonylContact O-C 3.55Å; I315-V336 VanDerWaalsContact O-CA 3.3Å; I315-V336 WeakPolarHBondContact O-CA 3.44Å; L316-V336 HydrophobicContact CD1-CB 3.85Å; L316-V336 HydrophobicContact CD1-CG2 4.1Å; V336-L347 HydrophobicContact CG2-CD2 3.97Å; V336-L348 HydrophobicContact CG1-CD2 3.53Å; V336-I351 HydrophobicContact CG1-CD1 4.15Å; V336-I351 HydrophobicContact CG2-CD1 4.01Å; V336-V423 PolarHBondContact N-O 2.93Å; V336-S424 WeakPolarHBondContact O-CA 3.24Å; V336-S424 PolarHBondContact O-OG 3.48Å
337	T	97.3	Very high	94.9	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	-178.1	177.5	-168.4	0	0	0	0	110.3	A314 I315 P425 F430	A314-T337 CarbonylContact C-O 3.59Å; A314-T337 WeakPolarHBondContact CA-O 3.26Å; I315-T337 HydrophobicContact CB-CG2 3.96Å; I315-T337 HydrophobicContact CD1-CG2 4.37Å; I315-T337 PolarHBondContact N-O 2.98Å; I315-T337 PolarHBondContact O-N 2.77Å; T337-P425 WeakPolarHBondContact CB-O 3.38Å; T337-P425 PolarHBondContact OG1-O 3.24Å; T337-F430 HydrophobicContact CG2-CD2 3.47Å; T337-F430 VanDerWaalsContact CG2-CD2 3.47Å; T337-F430 HydrophobicContact CG2-CE2 3.85Å; T337-F430 HydrophobicContact CG2-CG 4.38Å
338	T	95.7	Very high	95	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	150.6	172.9	179.2	0	0	0	0	108.9	T311 E340 K343 A427	T311-T338 PolarHBondContact OG1-OG1 3.41Å; T338-E340 PolarHBondContact O-N 3.34Å; T338-K343 HydrophobicContact CG2-CB 3.61Å; T338-A427 WeakPolarHBondContact O-CB 3.36Å
339	T	92.1	Very high	95	Very high	81 Å²	81	44.5 Å²	44.5	50%	0.497	23%	0.233	S	C	.	.	S	Bend	trans	-65.4	-18.9	-177.5	56.1	0	0	0	0	113.6	N313 I315	N313-T339 HydrophobicContact CB-CG2 4.49Å; N313-T339 WeakPolarHBondContact CB-OG1 3.49Å; N313-T339 PolarHBondContact O-N 3Å; I315-T339 HydrophobicContact CD1-CG2 4.08Å
340	E	90.4	Very high	95.1	Very high	75 Å²	75	45.9 Å²	45.9	35%	0.35	24%	0.241	S	C	.	.	S	Bend	trans	-89.6	111.6	179.7	-63.8	-177.1	-117.6	0	0	111	T338 K343	T338-E340 PolarHBondContact O-N 3.34Å; E340-K343 HydrophobicContact CB-CB 4.36Å; E340-K343 HydrophobicContact CB-CD 3.88Å; E340-K343 HydrophobicContact CB-CG 4.12Å; E340-K343 HydrophobicContact CG-CD 4.46Å; E340-K343 WeakPolarHBondContact O-CB 3.24Å; E340-K343 PolarHBondContact O-N 2.97Å; E340-K343 IonicContact OE1-NZ 2.73Å; E340-K343 PolarHBondContact OE1-NZ 3.37Å; E340-K343 WeakPolarHBondContact OE2-CD 3.25Å; E340-K343 WeakPolarHBondContact OE2-CE 3.03Å; E340-K343 IonicContact OE2-NZ 3.06Å; E340-K343 PolarHBondContact OE2-NZ 2.98Å
341	L	90.3	Very high	95.3	Very high	115 Å²	115	39.4 Å²	39.4	60%	0.602	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	137	-179.7	-66.9	171.7	0	0	0	112.4	K343 P426 A427 D428	L341-K343 VanDerWaalsContact C-N 3.27Å; L341-K343 PolarHBondContact O-N 3.49Å; L341-P426 HydrophobicContact CD2-CB 4.26Å; L341-A427 HydrophobicContact CD2-CB 3.98Å; L341-D428 HydrophobicContact CD2-CB 4.24Å
342	G	90.1	Very high	95.3	Very high	33 Å²	33	38.6 Å²	38.6	34%	0.34	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	-20	-178.8	0	0	0	0	0	113.8	E344 E345	G342-E344 VanDerWaalsContact C-N 3.26Å; G342-E344 WeakPolarHBondContact CA-OE2 3.41Å; G342-E344 PolarHBondContact N-OE1 2.98Å; G342-E344 PolarHBondContact N-OE2 3.18Å; G342-E344 PolarHBondContact O-N 2.93Å; G342-E345 WeakPolarHBondContact O-CG 3.44Å
343	K	91	Very high	95.3	Very high	113 Å²	113	43.5 Å²	43.5	49%	0.491	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-74.3	-18.3	177.6	-73.7	-164.1	176.4	171.9	0	112.9	T338 E340 L341 E345	T338-K343 HydrophobicContact CG2-CB 3.61Å; E340-K343 HydrophobicContact CB-CB 4.36Å; E340-K343 HydrophobicContact CB-CD 3.88Å; E340-K343 HydrophobicContact CB-CG 4.12Å; E340-K343 HydrophobicContact CG-CD 4.46Å; E340-K343 WeakPolarHBondContact O-CB 3.24Å; E340-K343 PolarHBondContact O-N 2.97Å; E340-K343 IonicContact OE1-NZ 2.73Å; E340-K343 PolarHBondContact OE1-NZ 3.37Å; E340-K343 WeakPolarHBondContact OE2-CD 3.25Å; E340-K343 WeakPolarHBondContact OE2-CE 3.03Å; E340-K343 IonicContact OE2-NZ 3.06Å; E340-K343 PolarHBondContact OE2-NZ 2.98Å; L341-K343 VanDerWaalsContact C-N 3.27Å; L341-K343 PolarHBondContact O-N 3.49Å; K343-E345 PolarHBondContact O-N 3.35Å
344	E	93.4	Very high	95.3	Very high	13 Å²	13	43.4 Å²	43.4	6%	0.061	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-64.5	-22	176.1	73.4	-76.4	173.1	0	0	113.8	G342 N346 L347 S424 P426	G342-E344 VanDerWaalsContact C-N 3.26Å; G342-E344 WeakPolarHBondContact CA-OE2 3.41Å; G342-E344 PolarHBondContact N-OE1 2.98Å; G342-E344 PolarHBondContact N-OE2 3.18Å; G342-E344 PolarHBondContact O-N 2.93Å; E344-N346 VanDerWaalsContact C-N 3.29Å; E344-N346 PolarHBondContact O-N 2.71Å; E344-L347 WeakPolarHBondContact O-CB 3.31Å; E344-L347 PolarHBondContact O-N 2.98Å; E344-S424 PolarHBondContact O-OG 2.94Å; E344-S424 VanDerWaalsContact O-OG 3.08Å; E344-P426 HydrophobicContact CG-CG 4.4Å; E344-P426 WeakPolarHBondContact OE1-CG 3.47Å
345	E	90.9	Very high	95.2	Very high	122 Å²	122	43 Å²	43	57%	0.57	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-59.8	-37.4	-174	-68.7	-175.8	171.6	0	0	112.9	G342 K343	G342-E345 WeakPolarHBondContact O-CG 3.44Å; K343-E345 PolarHBondContact O-N 3.35Å
346	N	93.1	Very high	95.2	Very high	100 Å²	100	50.2 Å²	50.2	54%	0.535	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-103.4	1.2	-178.4	-65.6	-57.3	0	0	0	113.2	E344 I349 S350	E344-N346 VanDerWaalsContact C-N 3.29Å; E344-N346 PolarHBondContact O-N 2.71Å; N346-I349 PolarHBondContact O-N 3.38Å; N346-S350 PolarHBondContact O-N 3.18Å; N346-S350 VanDerWaalsContact O-N 3.09Å; N346-S350 PolarHBondContact O-OG 3.49Å
347	L	96.2	Very high	95.2	Very high	6 Å²	6	58.5 Å²	58.5	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-46.3	-171.2	-170.4	59.2	0	0	0	111.6	V307 I310 T311 V336 E344 I349 S350 I351	V307-L347 HydrophobicContact CG2-CD1 3.71Å; V307-L347 HydrophobicContact CG2-CD2 4.25Å; V307-L347 HydrophobicContact CG2-CG 4.16Å; I310-L347 HydrophobicContact CG2-CD1 4.02Å; T311-L347 HydrophobicContact CG2-CD1 3.99Å; V336-L347 HydrophobicContact CG2-CD2 3.97Å; E344-L347 WeakPolarHBondContact O-CB 3.31Å; E344-L347 PolarHBondContact O-N 2.98Å; L347-I349 PolarHBondContact O-N 3.45Å; L347-S350 PolarHBondContact O-N 2.89Å; L347-I351 HydrophobicContact CG-CD1 4.09Å; L347-I351 VanDerWaalsContact O-CG1 3.3Å; L347-I351 WeakPolarHBondContact O-CG1 3.35Å; L347-I351 PolarHBondContact O-N 3.43Å
348	L	97.8	Very high	95.1	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-64.1	-39.3	179.3	-64.9	-174.9	0	0	0	112.6	V336 S350 I351 I352 Y366 A388 L422	V336-L348 HydrophobicContact CG1-CD2 3.53Å; L348-S350 VanDerWaalsContact C-N 3.33Å; L348-I351 HydrophobicContact CD2-CD1 4.39Å; L348-I351 PolarHBondContact O-N 3.06Å; L348-I352 WeakPolarHBondContact O-CB 3.42Å; L348-I352 WeakPolarHBondContact O-CD1 3.42Å; L348-I352 WeakPolarHBondContact O-CG1 3.42Å; L348-I352 PolarHBondContact O-N 3.5Å; L348-Y366 HydrophobicContact CB-CD2 4.28Å; L348-Y366 HydrophobicContact CB-CE2 4.1Å; L348-Y366 HydrophobicContact CD1-CE2 4.37Å; L348-A388 VanDerWaalsContact CD1-C 3.49Å; L348-A388 HydrophobicContact CD1-CB 4.02Å; L348-A388 WeakPolarHBondContact CD1-O 3.41Å; L348-L422 HydrophobicContact CD2-CB 3.79Å; L348-L422 HydrophobicContact CD2-CD1 4.13Å
349	I	97.5	Very high	95.2	Very high	58 Å²	58	64.7 Å²	64.7	30%	0.297	34%	0.338	S	S	.	.	H	α-helix	trans	-61.6	-46.8	177.1	-62.2	174.1	0	0	0	109.4	N346 L347 I351 I352 E353 Y366	N346-I349 PolarHBondContact O-N 3.38Å; L347-I349 PolarHBondContact O-N 3.45Å; I349-I351 PolarHBondContact O-N 3.16Å; I349-I352 PolarHBondContact O-N 3.44Å; I349-E353 WeakPolarHBondContact O-CG 3.35Å; I349-E353 PolarHBondContact O-N 2.82Å; I349-Y366 HydrophobicContact CD1-CE1 3.97Å; I349-Y366 HydrophobicContact CG1-CD1 4.44Å; I349-Y366 HydrophobicContact CG1-CD2 4.48Å; I349-Y366 HydrophobicContact CG1-CE1 4.05Å; I349-Y366 HydrophobicContact CG1-CE2 4.12Å
350	S	97.6	Very high	95.4	Very high	40 Å²	40	61.5 Å²	61.5	28%	0.28	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-40.8	179	-56.4	0	0	0	0	112.2	I310 N346 L347 L348 E353 S354	I310-S350 VanDerWaalsContact CD1-C 3.46Å; I310-S350 VanDerWaalsContact CD1-CB 3.49Å; N346-S350 PolarHBondContact O-N 3.18Å; N346-S350 VanDerWaalsContact O-N 3.09Å; N346-S350 PolarHBondContact O-OG 3.49Å; L347-S350 PolarHBondContact O-N 2.89Å; L348-S350 VanDerWaalsContact C-N 3.33Å; S350-E353 PolarHBondContact O-N 3.28Å; S350-S354 WeakPolarHBondContact O-CB 3.02Å; S350-S354 PolarHBondContact O-N 3.15Å
351	I	98.1	Very high	95.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-47.7	174.3	-69.2	165.5	0	0	0	110.4	V307 I310 V336 L347 L348 I349 E353 S354 L355 L422	V307-I351 HydrophobicContact CB-CD1 4.09Å; V307-I351 HydrophobicContact CB-CG1 4.19Å; V307-I351 HydrophobicContact CG2-CD1 3.85Å; V307-I351 HydrophobicContact CG2-CG1 4.18Å; I310-I351 HydrophobicContact CD1-CG1 3.83Å; V336-I351 HydrophobicContact CG1-CD1 4.15Å; V336-I351 HydrophobicContact CG2-CD1 4.01Å; L347-I351 HydrophobicContact CG-CD1 4.09Å; L347-I351 VanDerWaalsContact O-CG1 3.3Å; L347-I351 WeakPolarHBondContact O-CG1 3.35Å; L347-I351 PolarHBondContact O-N 3.43Å; L348-I351 HydrophobicContact CD2-CD1 4.39Å; L348-I351 PolarHBondContact O-N 3.06Å; I349-I351 PolarHBondContact O-N 3.16Å; I351-E353 VanDerWaalsContact C-N 3.32Å; I351-E353 PolarHBondContact O-N 2.95Å; I351-S354 WeakPolarHBondContact O-CB 3.25Å; I351-S354 PolarHBondContact O-N 3.38Å; I351-L355 HydrophobicContact CG2-CD1 3.74Å; I351-L355 HydrophobicContact CG2-CG 4.2Å; I351-L355 VanDerWaalsContact O-CG 3.31Å; I351-L355 WeakPolarHBondContact O-CG 3.35Å; I351-L355 PolarHBondContact O-N 3.29Å; I351-L422 HydrophobicContact CG2-CD1 4.21Å
352	I	98.1	Very high	96.2	Very high	21 Å²	21	56.5 Å²	56.5	11%	0.108	29%	0.294	C	S	.	.	H	α-helix	trans	-57.8	-45.6	178.8	-71.8	164.4	0	0	0	110.6	L348 I349 L355 K356 L361 Y366 C390 L392	L348-I352 WeakPolarHBondContact O-CB 3.42Å; L348-I352 WeakPolarHBondContact O-CD1 3.42Å; L348-I352 WeakPolarHBondContact O-CG1 3.42Å; L348-I352 PolarHBondContact O-N 3.5Å; I349-I352 PolarHBondContact O-N 3.44Å; I352-L355 PolarHBondContact O-N 2.91Å; I352-K356 VanDerWaalsContact O-CB 3.28Å; I352-K356 WeakPolarHBondContact O-CB 3.49Å; I352-K356 PolarHBondContact O-N 3.24Å; I352-L361 HydrophobicContact CG2-CD2 3.76Å; I352-Y366 HydrophobicContact CD1-CD2 4.47Å; I352-C390 HydrophobicContact CD1-CB 3.99Å; I352-L392 HydrophobicContact CD1-CD2 4.46Å; I352-L392 HydrophobicContact CG1-CD2 4.14Å
353	E	98	Very high	96.6	Very high	102 Å²	102	55.2 Å²	55.2	48%	0.477	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-41.8	177.1	-72.5	-176	178.4	0	0	112.6	I349 S350 I351 K356 K357	I349-E353 WeakPolarHBondContact O-CG 3.35Å; I349-E353 PolarHBondContact O-N 2.82Å; S350-E353 PolarHBondContact O-N 3.28Å; I351-E353 VanDerWaalsContact C-N 3.32Å; I351-E353 PolarHBondContact O-N 2.95Å; E353-K356 PolarHBondContact O-N 3.28Å; E353-K357 WeakPolarHBondContact O-CG 3.48Å; E353-K357 PolarHBondContact O-N 3.48Å
354	S	97.8	Very high	96.9	Very high	21 Å²	21	50.8 Å²	50.8	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-50.5	175.9	-176.4	0	0	0	0	111.5	S350 I351 K356 K357 Q358	S350-S354 WeakPolarHBondContact O-CB 3.02Å; S350-S354 PolarHBondContact O-N 3.15Å; I351-S354 WeakPolarHBondContact O-CB 3.25Å; I351-S354 PolarHBondContact O-N 3.38Å; S354-K356 VanDerWaalsContact C-N 3.28Å; S354-K356 PolarHBondContact O-N 2.9Å; S354-K357 PolarHBondContact O-N 2.76Å; S354-Q358 WeakPolarHBondContact O-CG 3.05Å; S354-Q358 PolarHBondContact O-N 3.43Å; S354-Q358 VanDerWaalsContact O-N 3.08Å; S354-Q358 PolarHBondContact OG-NE2 2.84Å
355	L	98.1	Very high	97.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-36	178.2	-65.9	173.6	0	0	0	112.1	I302 A306 I351 I352 Q358 G359 L360 L361 L392 L394	I302-L355 HydrophobicContact CG2-CD2 3.64Å; A306-L355 HydrophobicContact CB-CD2 4.14Å; A306-L355 HydrophobicContact CB-CG 4.49Å; I351-L355 HydrophobicContact CG2-CD1 3.74Å; I351-L355 HydrophobicContact CG2-CG 4.2Å; I351-L355 VanDerWaalsContact O-CG 3.31Å; I351-L355 WeakPolarHBondContact O-CG 3.35Å; I351-L355 PolarHBondContact O-N 3.29Å; I352-L355 PolarHBondContact O-N 2.91Å; L355-Q358 PolarHBondContact O-N 2.87Å; L355-G359 PolarHBondContact O-N 3.24Å; L355-L360 HydrophobicContact CD2-CD1 4.42Å; L355-L360 PolarHBondContact O-N 2.72Å; L355-L361 HydrophobicContact CB-CB 4.23Å; L355-L361 PolarHBondContact O-N 3.35Å; L355-L392 HydrophobicContact CD1-CD1 4.31Å; L355-L394 HydrophobicContact CD1-CD1 4.42Å; L355-L394 HydrophobicContact CD1-CD2 3.99Å
356	K	97.9	Very high	97.5	Very high	152 Å²	152	50.4 Å²	50.4	66%	0.661	26%	0.259	S	S	*	.	H	α-helix	trans	-65.5	-46.2	174.6	-173.9	180	178.4	-176.5	0	111.8	I352 E353 S354 Q358 G359 L361	I352-K356 VanDerWaalsContact O-CB 3.28Å; I352-K356 WeakPolarHBondContact O-CB 3.49Å; I352-K356 PolarHBondContact O-N 3.24Å; E353-K356 PolarHBondContact O-N 3.28Å; S354-K356 VanDerWaalsContact C-N 3.28Å; S354-K356 PolarHBondContact O-N 2.9Å; K356-Q358 PolarHBondContact O-N 3.45Å; K356-G359 PolarHBondContact O-N 2.92Å; K356-L361 HydrophobicContact CB-CB 4.4Å; K356-L361 HydrophobicContact CB-CD2 4.02Å
357	K	97.3	Very high	97.6	Very high	174 Å²	174	49.6 Å²	49.6	76%	0.757	25%	0.252	S	S	*	.	H	α-helix	trans	-60.7	-32.7	177.1	-74.8	171.4	-176.2	170.2	0	112.2	E353 S354 G359	E353-K357 WeakPolarHBondContact O-CG 3.48Å; E353-K357 PolarHBondContact O-N 3.48Å; S354-K357 PolarHBondContact O-N 2.76Å; K357-G359 VanDerWaalsContact C-N 3.28Å; K357-G359 PolarHBondContact O-N 3.24Å
358	Q	96	Very high	97.6	Very high	83 Å²	83	52.1 Å²	52.1	39%	0.388	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.9	176.2	-65	178.5	52.4	0	0	113.9	S354 L355 K356 L360	S354-Q358 WeakPolarHBondContact O-CG 3.05Å; S354-Q358 PolarHBondContact O-N 3.43Å; S354-Q358 VanDerWaalsContact O-N 3.08Å; S354-Q358 PolarHBondContact OG-NE2 2.84Å; L355-Q358 PolarHBondContact O-N 2.87Å; K356-Q358 PolarHBondContact O-N 3.45Å; Q358-L360 HydrophobicContact CB-CD1 4Å; Q358-L360 HydrophobicContact CB-CG 3.94Å; Q358-L360 PolarHBondContact O-N 3.03Å
359	G	96.9	Very high	97.6	Very high	49 Å²	49	54.9 Å²	54.9	51%	0.505	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	17.6	-176.6	0	0	0	0	0	114.3	L355 K356 K357	L355-G359 PolarHBondContact O-N 3.24Å; K356-G359 PolarHBondContact O-N 2.92Å; K357-G359 VanDerWaalsContact C-N 3.28Å; K357-G359 PolarHBondContact O-N 3.24Å
360	L	97.8	Very high	97.5	Very high	13 Å²	13	56.5 Å²	56.5	7%	0.068	31%	0.306	C	S	.	.			trans	-92.2	-16.2	-178.1	-62.3	177.2	0	0	0	113	I302 L355 Q358 L394 R395	I302-L360 HydrophobicContact CG2-CD1 3.65Å; L355-L360 HydrophobicContact CD2-CD1 4.42Å; L355-L360 PolarHBondContact O-N 2.72Å; Q358-L360 HydrophobicContact CB-CD1 4Å; Q358-L360 HydrophobicContact CB-CG 3.94Å; Q358-L360 PolarHBondContact O-N 3.03Å; L360-L394 CarbonylContact O-C 3.56Å; L360-L394 WeakPolarHBondContact O-CA 3.49Å; L360-R395 PolarHBondContact O-N 2.86Å
361	L	98.4	Very high	97.3	Very high	32 Å²	32	57 Å²	57	17%	0.168	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	117	-177.2	-172.1	69.6	0	0	0	111.9	I352 L355 K356 F363 L392 L394	I352-L361 HydrophobicContact CG2-CD2 3.76Å; L355-L361 HydrophobicContact CB-CB 4.23Å; L355-L361 PolarHBondContact O-N 3.35Å; K356-L361 HydrophobicContact CB-CB 4.4Å; K356-L361 HydrophobicContact CB-CD2 4.02Å; L361-F363 VanDerWaalsContact CD1-O 3.26Å; L361-F363 WeakPolarHBondContact CD1-O 3.49Å; L361-L392 HydrophobicContact CD1-CB 4.49Å; L361-L392 HydrophobicContact CD1-CD2 4.09Å; L361-L394 HydrophobicContact CD1-CD2 3.8Å
362	L	98.3	Very high	97.1	Very high	53 Å²	53	59.7 Å²	59.7	28%	0.277	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-37.8	175.7	-58.2	175.8	0	0	0	111.9	I393 R395 W415 A417	L362-I393 WeakPolarHBondContact CA-O 3.19Å; L362-I393 HydrophobicContact CB-CB 4.22Å; L362-I393 HydrophobicContact CB-CG2 4.07Å; L362-I393 WeakPolarHBondContact CB-O 3.35Å; L362-I393 HydrophobicContact CD1-CG2 4.03Å; L362-I393 PolarHBondContact N-O 3.47Å; L362-R395 HydrophobicContact CD1-CB 4.02Å; L362-R395 HydrophobicContact CD2-CB 4.16Å; L362-R395 HydrophobicContact CG-CB 4.02Å; L362-W415 HydrophobicContact CD1-CH2 4.42Å; L362-W415 HydrophobicContact CD1-CZ3 3.81Å; L362-A417 HydrophobicContact CD1-CB 3.79Å
363	F	98.4	Very high	96.6	Very high	6 Å²	6	64.3 Å²	64.3	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	148.8	177.1	173.1	-93.6	0	0	0	110.6	F244 R275 M276 S279 L361 D365 L392 I393	F244-F363 AromaticContact CE1-CD1 3.75Å; F244-F363 HydrophobicContact CE1-CD1 3.75Å; F244-F363 AromaticContact CE1-CE1 3.54Å; F244-F363 HydrophobicContact CE1-CE1 3.54Å; F244-F363 HydrophobicContact CE1-CG 4.48Å; F244-F363 HydrophobicContact CE1-CZ 4.11Å; F244-F363 HydrophobicContact CZ-CD1 4.18Å; F244-F363 AromaticContact CZ-CE1 3.72Å; F244-F363 HydrophobicContact CZ-CE1 3.72Å; F244-F363 HydrophobicContact CZ-CZ 4.45Å; R275-F363 HydrophobicContact CB-CE2 4.46Å; R275-F363 HydrophobicContact CG-CD2 4.36Å; R275-F363 HydrophobicContact CG-CE2 3.95Å; M276-F363 HydrophobicContact CB-CE2 4.33Å; M276-F363 HydrophobicContact CB-CZ 3.95Å; M276-F363 HydrophobicContact CG-CE1 4.28Å; M276-F363 HydrophobicContact CG-CZ 3.83Å; S279-F363 WeakPolarHBondContact OG-CD2 3.23Å; L361-F363 VanDerWaalsContact CD1-O 3.26Å; L361-F363 WeakPolarHBondContact CD1-O 3.49Å; F363-D365 HydrophobicContact CE1-CB 3.83Å; F363-D365 HydrophobicContact CZ-CB 3.85Å; F363-L392 WeakPolarHBondContact O-CA 3.48Å; F363-I393 HydrophobicContact CB-CB 3.83Å; F363-I393 HydrophobicContact CB-CD1 3.92Å; F363-I393 HydrophobicContact CB-CG1 3.85Å; F363-I393 HydrophobicContact CD1-CD1 4.49Å; F363-I393 HydrophobicContact CD1-CG1 4.22Å; F363-I393 HydrophobicContact CG-CD1 4.37Å; F363-I393 HydrophobicContact CG-CG1 4.4Å; F363-I393 PolarHBondContact N-O 3.43Å; F363-I393 PolarHBondContact O-N 2.91Å
364	S	98.1	Very high	96.2	Very high	20 Å²	20	64 Å²	64	14%	0.14	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	131.2	170.8	64	0	0	0	0	111.2	R275 F391	R275-S364 PolarHBondContact NH1-O 3.47Å; S364-F391 CarbonylContact C-O 3.54Å; S364-F391 WeakPolarHBondContact CA-O 3.5Å
365	D	97.6	Very high	96.1	Very high	49 Å²	49	69.2 Å²	69.2	26%	0.262	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	110.2	162.9	-176.9	45.8	0	0	0	108.4	F363 Q367 C390 F391	F363-D365 HydrophobicContact CE1-CB 3.83Å; F363-D365 HydrophobicContact CZ-CB 3.85Å; D365-Q367 PolarHBondContact OD2-NE2 3.04Å; D365-Q367 VanDerWaalsContact OD2-NE2 3.11Å; D365-C390 CarbonylContact O-C 3.58Å; D365-C390 WeakPolarHBondContact O-CA 3.29Å; D365-C390 WeakPolarHBondContact O-CB 3.32Å; D365-F391 HydrophobicContact CB-CB 4.34Å; D365-F391 HydrophobicContact CB-CD2 4.41Å; D365-F391 PolarHBondContact N-O 3.28Å; D365-F391 PolarHBondContact O-N 3.44Å
366	Y	97.6	Very high	95.9	Very high	79 Å²	79	73.4 Å²	73.4	31%	0.31	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.4	179.2	168.8	-106.8	0	0	0	109.8	L348 I349 I352 A368 A388 C390	L348-Y366 HydrophobicContact CB-CD2 4.28Å; L348-Y366 HydrophobicContact CB-CE2 4.1Å; L348-Y366 HydrophobicContact CD1-CE2 4.37Å; I349-Y366 HydrophobicContact CD1-CE1 3.97Å; I349-Y366 HydrophobicContact CG1-CD1 4.44Å; I349-Y366 HydrophobicContact CG1-CD2 4.48Å; I349-Y366 HydrophobicContact CG1-CE1 4.05Å; I349-Y366 HydrophobicContact CG1-CE2 4.12Å; I352-Y366 HydrophobicContact CD1-CD2 4.47Å; Y366-A368 HydrophobicContact CE1-CB 4.04Å; Y366-A388 HydrophobicContact CE2-CB 4.26Å; Y366-C390 HydrophobicContact CD2-CB 4.39Å
367	Q	96.6	Very high	95.8	Very high	82 Å²	82	66.3 Å²	66.3	38%	0.383	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	116.6	175.8	-56.6	-174.7	3.4	0	0	108.3	D365 A388 K389	D365-Q367 PolarHBondContact OD2-NE2 3.04Å; D365-Q367 VanDerWaalsContact OD2-NE2 3.11Å; Q367-A388 WeakPolarHBondContact O-CA 3.46Å; Q367-K389 HydrophobicContact CB-CG 3.84Å; Q367-K389 HydrophobicContact CG-CG 4.45Å; Q367-K389 PolarHBondContact N-O 2.86Å; Q367-K389 PolarHBondContact O-N 3.12Å
368	A	96.4	Very high	95.6	Very high	60 Å²	60	59.6 Å²	59.6	50%	0.496	34%	0.337	S	S	.	.			trans	-63.5	153.6	178.3	0	0	0	0	0	111.5	Y366 T370	Y366-A368 HydrophobicContact CE1-CB 4.04Å; A368-T370 PolarHBondContact O-N 3.46Å
369	S	96.4	Very high	95.5	Very high	58 Å²	58	60.6 Å²	60.6	41%	0.406	34%	0.342	S	S	.	.			trans	-59.5	133.9	174	-172.3	0	0	0	0	110.5	F371 H386	S369-F371 WeakPolarHBondContact OG-CB 3.31Å; S369-F371 PolarHBondContact OG-N 3.23Å; S369-H386 CarbonylContact C-O 3.54Å; S369-H386 WeakPolarHBondContact CA-O 3.39Å; S369-H386 PolarHBondContact OG-O 2.85Å
370	T	95.6	Very high	95.3	Very high	92 Å²	92	67.3 Å²	67.3	56%	0.564	35%	0.352	S	S	*	.			trans	-115.1	12.8	168.5	55.2	0	0	0	0	111	A368 H386	A368-T370 PolarHBondContact O-N 3.46Å; T370-H386 PolarHBondContact N-O 3.49Å; T370-H386 PolarHBondContact OG1-ND1 2.76Å
371	F	94.9	Very high	95	Very high	51 Å²	51	68.3 Å²	68.3	22%	0.224	36%	0.356	C	S	.	.			trans	-64.8	136.2	-178.3	178.5	-117.8	0	0	0	110.4	S369 L373 H386 F387 H462	S369-F371 WeakPolarHBondContact OG-CB 3.31Å; S369-F371 PolarHBondContact OG-N 3.23Å; F371-L373 HydrophobicContact CE1-CD2 3.66Å; F371-L373 HydrophobicContact CE1-CG 3.85Å; F371-L373 HydrophobicContact CZ-CD2 3.88Å; F371-L373 HydrophobicContact CZ-CG 4.3Å; F371-H386 HydrophobicContact CB-CB 4.1Å; F371-H386 PolarHBondContact N-O 3.13Å; F371-F387 HydrophobicContact CB-CD1 3.96Å; F371-F387 HydrophobicContact CB-CE1 4.06Å; F371-F387 HydrophobicContact CD1-CD1 4.28Å; F371-F387 AromaticContact CD1-CE1 3.65Å; F371-F387 HydrophobicContact CD1-CE1 3.65Å; F371-F387 AromaticContact CD2-CE1 3.9Å; F371-F387 HydrophobicContact CD2-CE1 3.9Å; F371-F387 HydrophobicContact CD2-CZ 4.37Å; F371-F387 HydrophobicContact CE1-CE1 4.01Å; F371-F387 HydrophobicContact CE2-CE1 4.28Å; F371-F387 HydrophobicContact CE2-CZ 4.46Å; F371-F387 HydrophobicContact CG-CD1 4.01Å; F371-F387 AromaticContact CG-CE1 3.57Å; F371-F387 HydrophobicContact CG-CE1 3.57Å; F371-F387 HydrophobicContact CG-CZ 4.46Å; F371-F387 HydrophobicContact CZ-CE1 4.32Å; F371-H462 HydrophobicContact CD2-CB 4.1Å; F371-H462 AromaticContact CD2-CD2 3.59Å; F371-H462 AromaticContact CD2-CG 3.9Å; F371-H462 HydrophobicContact CE2-CB 3.48Å; F371-H462 VanDerWaalsContact CE2-CB 3.48Å; F371-H462 AromaticContact CE2-CD2 3.92Å; F371-H462 AromaticContact CE2-CG 3.78Å; F371-H462 HydrophobicContact CZ-CB 4.22Å
372	D	92.5	Very high	94.4	Very high	57 Å²	57	72.6 Å²	72.6	31%	0.305	38%	0.375	S	S	.	.			trans	-135.5	111.9	-175.7	178.9	-10	0	0	0	108.1	S374 K375	D372-S374 VanDerWaalsContact CG-OG 3.28Å; D372-S374 PolarHBondContact O-N 3.49Å; D372-S374 VanDerWaalsContact O-N 3.16Å; D372-S374 WeakPolarHBondContact OD1-CB 3.43Å; D372-S374 PolarHBondContact OD1-N 3.46Å; D372-S374 PolarHBondContact OD1-OG 3.28Å; D372-S374 PolarHBondContact OD2-OG 2.97Å; D372-K375 HydrophobicContact CB-CB 4.42Å; D372-K375 HydrophobicContact CB-CD 3.89Å; D372-K375 HydrophobicContact CB-CG 3.99Å; D372-K375 PolarHBondContact O-N 2.74Å; D372-K375 VanDerWaalsContact O-N 3.08Å; D372-K375 WeakPolarHBondContact OD2-CE 3.47Å; D372-K375 IonicContact OD2-NZ 3.85Å
373	L	89.1	Confident	93.6	Very high	117 Å²	117	70.9 Å²	70.9	61%	0.613	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22	-178.5	-75.7	161	0	0	0	113.1	F371 K375	F371-L373 HydrophobicContact CE1-CD2 3.66Å; F371-L373 HydrophobicContact CE1-CG 3.85Å; F371-L373 HydrophobicContact CZ-CD2 3.88Å; F371-L373 HydrophobicContact CZ-CG 4.3Å; L373-K375 VanDerWaalsContact C-N 3.33Å
374	S	89.6	Confident	92.7	Very high	95 Å²	95	76.1 Å²	76.1	66%	0.664	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-15.4	178.8	74.4	0	0	0	0	113.2	D372	D372-S374 VanDerWaalsContact CG-OG 3.28Å; D372-S374 PolarHBondContact O-N 3.49Å; D372-S374 VanDerWaalsContact O-N 3.16Å; D372-S374 WeakPolarHBondContact OD1-CB 3.43Å; D372-S374 PolarHBondContact OD1-N 3.46Å; D372-S374 PolarHBondContact OD1-OG 3.28Å; D372-S374 PolarHBondContact OD2-OG 2.97Å
375	K	93.9	Very high	92.4	Very high	132 Å²	132	75.5 Å²	75.5	57%	0.574	39%	0.389	S	S	*	.	S	Bend	trans	-85.3	137.9	-176.7	-71.7	-178.2	-174	152.3	0	111.6	D372 L373	D372-K375 HydrophobicContact CB-CB 4.42Å; D372-K375 HydrophobicContact CB-CD 3.89Å; D372-K375 HydrophobicContact CB-CG 3.99Å; D372-K375 PolarHBondContact O-N 2.74Å; D372-K375 VanDerWaalsContact O-N 3.08Å; D372-K375 WeakPolarHBondContact OD2-CE 3.47Å; D372-K375 IonicContact OD2-NZ 3.85Å; L373-K375 VanDerWaalsContact C-N 3.33Å
376	L	94.7	Very high	92.3	Very high	87 Å²	87	76.9 Å²	76.9	46%	0.455	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-67.3	154	168.9	-66	178.7	0	0	0	110.9	L458 F465 F472	L376-L458 HydrophobicContact CB-CD1 4.42Å; L376-F465 HydrophobicContact CD2-CD1 3.91Å; L376-F465 HydrophobicContact CD2-CD2 3.61Å; L376-F465 HydrophobicContact CD2-CE1 3.92Å; L376-F465 HydrophobicContact CD2-CE2 3.62Å; L376-F465 HydrophobicContact CD2-CG 3.75Å; L376-F465 HydrophobicContact CD2-CZ 3.78Å; L376-F472 HydrophobicContact CD2-CE2 4.44Å; L376-F472 HydrophobicContact CD2-CZ 4Å
377	P	94.8	Very high	92.3	Very high	3 Å²	3	73.2 Å²	73.2	2%	0.019	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-56.9	146.4	175.1	-24.2	34.9	0	0	0	112	L458 D460 A463 F465 F472	P377-L458 HydrophobicContact CB-CB 3.87Å; P377-L458 HydrophobicContact CG-CB 4.18Å; P377-D460 WeakPolarHBondContact CA-OD2 3.29Å; P377-D460 HydrophobicContact CB-CB 4.15Å; P377-A463 HydrophobicContact CG-CB 4.29Å; P377-F465 HydrophobicContact CG-CB 3.85Å; P377-F472 HydrophobicContact CG-CE1 4.32Å
378	S	94.4	Very high	92.4	Very high	33 Å²	33	69.4 Å²	69.4	23%	0.231	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-59.4	140.8	-173.1	-174.1	0	0	0	0	113.5	R380 A383 D460	S378-R380 VanDerWaalsContact C-N 3.28Å; S378-R380 PolarHBondContact OG-N 3.4Å; S378-R380 VanDerWaalsContact OG-N 3.13Å; S378-A383 WeakPolarHBondContact OG-CB 2.92Å; S378-D460 PolarHBondContact N-OD2 3.47Å
379	H	92.9	Very high	92.4	Very high	105 Å²	105	67.4 Å²	67.4	49%	0.486	34%	0.342	S	S	.	.	S	Bend	trans	-79.4	-8.3	170.4	-74.2	-111.7	0	0	0	113.1	R452	H379-R452 PolarHBondContact O-NH1 3.01Å
380	R	92.9	Very high	92.4	Very high	189 Å²	189	64.7 Å²	64.7	71%	0.713	32%	0.323	S	S	*	.			trans	-88.4	131.3	178.8	-52.8	-174.6	-161.6	-173.7	5.2	109.8	S378 E382 A383	S378-R380 VanDerWaalsContact C-N 3.28Å; S378-R380 PolarHBondContact OG-N 3.4Å; S378-R380 VanDerWaalsContact OG-N 3.13Å; R380-E382 PolarHBondContact O-N 3.02Å; R380-A383 HydrophobicContact CB-CB 4.16Å; R380-A383 PolarHBondContact O-N 2.85Å
381	F	91.5	Very high	92.5	Very high	35 Å²	35	62.5 Å²	62.5	15%	0.154	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.3	-179	-57.9	-49.2	0	0	0	112.7	R445 R448 R449 R452	F381-R445 HydrophobicContact CB-CG 3.58Å; F381-R448 HydrophobicContact CD1-CB 3.96Å; F381-R448 PolarHBondContact O-NH1 3.41Å; F381-R449 HydrophobicContact CD1-CB 4.28Å; F381-R449 HydrophobicContact CE1-CB 3.87Å; F381-R449 HydrophobicContact CE1-CG 4.26Å; F381-R449 HydrophobicContact CE2-CB 4.29Å; F381-R449 HydrophobicContact CE2-CG 4.08Å; F381-R449 HydrophobicContact CZ-CB 3.8Å; F381-R449 HydrophobicContact CZ-CG 3.69Å; F381-R452 HydrophobicContact CE1-CB 4.42Å; F381-R452 VanDerWaalsContact CE2-NH2 3.29Å
382	E	86.2	Confident	92.7	Very high	122 Å²	122	60.1 Å²	60.1	57%	0.57	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	6.4	-179.2	-55.8	75	-162.4	0	0	112.7	R380 M384 R445	R380-E382 PolarHBondContact O-N 3.02Å; E382-M384 PolarHBondContact O-N 3.25Å; E382-R445 WeakPolarHBondContact OE1-CD 3.48Å
383	A	81.5	Confident	93	Very high	16 Å²	16	57.4 Å²	57.4	13%	0.132	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-59.5	136.1	-178.5	0	0	0	0	0	111.9	S378 R380 R448	S378-A383 WeakPolarHBondContact OG-CB 2.92Å; R380-A383 HydrophobicContact CB-CB 4.16Å; R380-A383 PolarHBondContact O-N 2.85Å; A383-R448 PolarHBondContact O-NH1 3.42Å; A383-R448 PolarHBondContact O-NH2 3.49Å; A383-R448 VanDerWaalsContact O-NH2 3.08Å
384	M	80.4	Confident	93.5	Very high	116 Å²	116	51.9 Å²	51.9	57%	0.571	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-86.6	165.1	167	-64	-80.8	60.9	0	0	110.7	E382	E382-M384 PolarHBondContact O-N 3.25Å
385	D	91.3	Very high	93.8	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.037	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-72.7	163.5	178	68.5	85.2	0	0	0	112	F387 K389 W437 N461 H462	D385-F387 HydrophobicContact CB-CD2 4.06Å; D385-F387 PolarHBondContact OD1-N 3.48Å; D385-K389 PolarHBondContact O-NZ 3.22Å; D385-K389 WeakPolarHBondContact OD1-CE 3.19Å; D385-K389 IonicContact OD1-NZ 3.75Å; D385-K389 PolarHBondContact OD1-NZ 2.98Å; D385-K389 IonicContact OD2-NZ 2.72Å; D385-W437 VanDerWaalsContact OD2-CE2 3.31Å; D385-W437 VanDerWaalsContact OD2-CZ2 3.29Å; D385-W437 WeakPolarHBondContact OD2-CZ2 3.31Å; D385-W437 PolarHBondContact OD2-NE1 3.28Å; D385-N461 HydrophobicContact CB-CB 3.69Å; D385-H462 VanDerWaalsContact CA-NE2 3.26Å; D385-H462 WeakPolarHBondContact CA-NE2 3.26Å
386	H	96	Very high	94	Very high	79 Å²	79	44.9 Å²	44.9	37%	0.366	21%	0.208	S	C	.	.			trans	-105.3	6.1	178.8	-66	-66.6	0	0	0	111.9	S369 T370 F371 H462	S369-H386 CarbonylContact C-O 3.54Å; S369-H386 WeakPolarHBondContact CA-O 3.39Å; S369-H386 PolarHBondContact OG-O 2.85Å; T370-H386 PolarHBondContact N-O 3.49Å; T370-H386 PolarHBondContact OG1-ND1 2.76Å; F371-H386 HydrophobicContact CB-CB 4.1Å; F371-H386 PolarHBondContact N-O 3.13Å; H386-H462 AromaticContact CD2-CE1 3.45Å; H386-H462 PolarHBondContact CD2-CE1 2.71Å; H386-H462 VanDerWaalsContact CD2-CE1 3.45Å; H386-H462 AromaticContact CD2-NE2 3.62Å; H386-H462 AromaticContact CG-NE2 3.91Å; H386-H462 PolarHBondContact N-NE2 3.37Å
387	F	97	Very high	94.1	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	20%	0.197	C	C	.	.	S	Bend	trans	-72.4	163.9	176.6	-62.1	-53.2	0	0	0	111.5	F371 D385 K389 V423 P425 P426 R429 T433 H462	F371-F387 HydrophobicContact CB-CD1 3.96Å; F371-F387 HydrophobicContact CB-CE1 4.06Å; F371-F387 HydrophobicContact CD1-CD1 4.28Å; F371-F387 AromaticContact CD1-CE1 3.65Å; F371-F387 HydrophobicContact CD1-CE1 3.65Å; F371-F387 AromaticContact CD2-CE1 3.9Å; F371-F387 HydrophobicContact CD2-CE1 3.9Å; F371-F387 HydrophobicContact CD2-CZ 4.37Å; F371-F387 HydrophobicContact CE1-CE1 4.01Å; F371-F387 HydrophobicContact CE2-CE1 4.28Å; F371-F387 HydrophobicContact CE2-CZ 4.46Å; F371-F387 HydrophobicContact CG-CD1 4.01Å; F371-F387 AromaticContact CG-CE1 3.57Å; F371-F387 HydrophobicContact CG-CE1 3.57Å; F371-F387 HydrophobicContact CG-CZ 4.46Å; F371-F387 HydrophobicContact CZ-CE1 4.32Å; D385-F387 HydrophobicContact CB-CD2 4.06Å; D385-F387 PolarHBondContact OD1-N 3.48Å; F387-K389 PolarHBondContact O-N 3.41Å; F387-K389 PolarHBondContact O-NZ 3.17Å; F387-V423 HydrophobicContact CB-CG2 3.85Å; F387-P425 HydrophobicContact CD1-CB 4.29Å; F387-P425 HydrophobicContact CD2-CB 3.68Å; F387-P425 HydrophobicContact CE1-CB 4.36Å; F387-P425 HydrophobicContact CE2-CB 3.76Å; F387-P425 HydrophobicContact CG-CB 3.96Å; F387-P425 HydrophobicContact CZ-CB 4.1Å; F387-P426 VanDerWaalsContact CD1-CD 3.49Å; F387-P426 HydrophobicContact CE1-CG 4.1Å; F387-R429 HydrophobicContact CE1-CB 4.31Å; F387-R429 HydrophobicContact CE1-CG 4.35Å; F387-R429 HydrophobicContact CE2-CB 4.27Å; F387-R429 HydrophobicContact CZ-CB 3.56Å; F387-R429 HydrophobicContact CZ-CG 3.93Å; F387-T433 HydrophobicContact CD2-CG2 4.31Å; F387-T433 WeakPolarHBondContact CE2-OG1 3.11Å; F387-H462 AromaticContact CD2-CD2 3.95Å; F387-H462 HydrophobicContact CE2-CB 4.29Å; F387-H462 AromaticContact CE2-CD2 3.46Å; F387-H462 VanDerWaalsContact CE2-CD2 3.46Å; F387-H462 WeakPolarHBondContact CE2-CD2 3.47Å; F387-H462 HydrophobicContact CZ-CB 3.91Å; F387-H462 AromaticContact CZ-CD2 3.5Å
388	A	97.4	Very high	94.1	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	132.9	171.1	0	0	0	0	0	108.8	L348 Y366 Q367 S424	L348-A388 VanDerWaalsContact CD1-C 3.49Å; L348-A388 HydrophobicContact CD1-CB 4.02Å; L348-A388 WeakPolarHBondContact CD1-O 3.41Å; Y366-A388 HydrophobicContact CE2-CB 4.26Å; Q367-A388 WeakPolarHBondContact O-CA 3.46Å; A388-S424 PolarHBondContact O-N 2.8Å
389	K	97.1	Very high	94.1	Very high	18 Å²	18	47.3 Å²	47.3	8%	0.078	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	152.1	-178.9	59.4	-175.6	59.7	66	0	110.7	Q367 D385 F387 F391 L422	Q367-K389 HydrophobicContact CB-CG 3.84Å; Q367-K389 HydrophobicContact CG-CG 4.45Å; Q367-K389 PolarHBondContact N-O 2.86Å; Q367-K389 PolarHBondContact O-N 3.12Å; D385-K389 PolarHBondContact O-NZ 3.22Å; D385-K389 WeakPolarHBondContact OD1-CE 3.19Å; D385-K389 IonicContact OD1-NZ 3.75Å; D385-K389 PolarHBondContact OD1-NZ 2.98Å; D385-K389 IonicContact OD2-NZ 2.72Å; F387-K389 PolarHBondContact O-N 3.41Å; F387-K389 PolarHBondContact O-NZ 3.17Å; K389-F391 HydrophobicContact CD-CE2 4.48Å; K389-F391 HydrophobicContact CD-CZ 4.15Å; K389-L422 CarbonylContact C-O 3.5Å; K389-L422 WeakPolarHBondContact CA-O 3.45Å; K389-L422 WeakPolarHBondContact CB-O 3.41Å
390	C	97.3	Very high	94.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	139.2	170.8	65.3	0	0	0	0	112.7	I352 D365 Y366 L392 L422	I352-C390 HydrophobicContact CD1-CB 3.99Å; D365-C390 CarbonylContact O-C 3.58Å; D365-C390 WeakPolarHBondContact O-CA 3.29Å; D365-C390 WeakPolarHBondContact O-CB 3.32Å; Y366-C390 HydrophobicContact CD2-CB 4.39Å; C390-L392 HydrophobicContact CB-CD2 4.05Å; C390-L422 PolarHBondContact N-O 3.5Å; C390-L422 PolarHBondContact O-N 3.23Å
391	F	97.9	Very high	94.4	Very high	47 Å²	47	38.7 Å²	38.7	21%	0.206	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.7	175.5	-54.9	-67.9	0	0	0	108.4	F244 S364 D365 K389 D421	F244-F391 HydrophobicContact CZ-CB 4.42Å; S364-F391 CarbonylContact C-O 3.54Å; S364-F391 WeakPolarHBondContact CA-O 3.5Å; D365-F391 HydrophobicContact CB-CB 4.34Å; D365-F391 HydrophobicContact CB-CD2 4.41Å; D365-F391 PolarHBondContact N-O 3.28Å; D365-F391 PolarHBondContact O-N 3.44Å; K389-F391 HydrophobicContact CD-CE2 4.48Å; K389-F391 HydrophobicContact CD-CZ 4.15Å; F391-D421 HydrophobicContact CD1-CB 4.22Å; F391-D421 WeakPolarHBondContact CD1-OD1 3.39Å; F391-D421 HydrophobicContact CE1-CB 4.47Å
392	L	98.6	Very high	94.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153.9	-171.4	-48.7	178.5	0	0	0	110.9	I352 L355 L361 F363 C390 L394 R419 V420 L422	I352-L392 HydrophobicContact CD1-CD2 4.46Å; I352-L392 HydrophobicContact CG1-CD2 4.14Å; L355-L392 HydrophobicContact CD1-CD1 4.31Å; L361-L392 HydrophobicContact CD1-CB 4.49Å; L361-L392 HydrophobicContact CD1-CD2 4.09Å; F363-L392 WeakPolarHBondContact O-CA 3.48Å; C390-L392 HydrophobicContact CB-CD2 4.05Å; L392-L394 HydrophobicContact CB-CD2 4.11Å; L392-L394 HydrophobicContact CB-CG 4.41Å; L392-L394 HydrophobicContact CD1-CD2 4.26Å; L392-R419 WeakPolarHBondContact O-CA 3.47Å; L392-V420 WeakPolarHBondContact CA-O 3.32Å; L392-V420 HydrophobicContact CB-CB 4.29Å; L392-V420 WeakPolarHBondContact CB-O 3.26Å; L392-V420 PolarHBondContact N-O 2.87Å; L392-V420 PolarHBondContact O-N 3.3Å; L392-L422 HydrophobicContact CD1-CD1 3.79Å; L392-L422 HydrophobicContact CD1-CG 4.12Å
393	I	98.7	Very high	94.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.9	157.1	-56.9	177.3	0	0	0	106.4	F244 I287 L362 F363 A417 V418	F244-I393 HydrophobicContact CD1-CD1 3.94Å; F244-I393 HydrophobicContact CE1-CD1 4.07Å; F244-I393 HydrophobicContact CE1-CG1 4.38Å; I287-I393 HydrophobicContact CD1-CD1 4.44Å; I287-I393 HydrophobicContact CG2-CG2 4.3Å; L362-I393 WeakPolarHBondContact CA-O 3.19Å; L362-I393 HydrophobicContact CB-CB 4.22Å; L362-I393 HydrophobicContact CB-CG2 4.07Å; L362-I393 WeakPolarHBondContact CB-O 3.35Å; L362-I393 HydrophobicContact CD1-CG2 4.03Å; L362-I393 PolarHBondContact N-O 3.47Å; F363-I393 HydrophobicContact CB-CB 3.83Å; F363-I393 HydrophobicContact CB-CD1 3.92Å; F363-I393 HydrophobicContact CB-CG1 3.85Å; F363-I393 HydrophobicContact CD1-CD1 4.49Å; F363-I393 HydrophobicContact CD1-CG1 4.22Å; F363-I393 HydrophobicContact CG-CD1 4.37Å; F363-I393 HydrophobicContact CG-CG1 4.4Å; F363-I393 PolarHBondContact N-O 3.43Å; F363-I393 PolarHBondContact O-N 2.91Å; I393-A417 HydrophobicContact CG2-CB 3.64Å; I393-V418 WeakPolarHBondContact CA-O 3.49Å
394	L	98.5	Very high	95.1	Very high	2 Å²	2	43 Å²	43	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	145.3	179.4	-57.4	-171.1	0	0	0	111	V299 I303 L355 L360 L361 L392 A417 V418 V420	V299-L394 HydrophobicContact CG1-CD1 4.29Å; I303-L394 HydrophobicContact CD1-CD1 4.24Å; I303-L394 HydrophobicContact CG1-CD1 4.33Å; L355-L394 HydrophobicContact CD1-CD1 4.42Å; L355-L394 HydrophobicContact CD1-CD2 3.99Å; L360-L394 CarbonylContact O-C 3.56Å; L360-L394 WeakPolarHBondContact O-CA 3.49Å; L361-L394 HydrophobicContact CD1-CD2 3.8Å; L392-L394 HydrophobicContact CB-CD2 4.11Å; L392-L394 HydrophobicContact CB-CG 4.41Å; L392-L394 HydrophobicContact CD1-CD2 4.26Å; L394-A417 CarbonylContact O-C 3.48Å; L394-A417 WeakPolarHBondContact O-CA 3.43Å; L394-V418 PolarHBondContact N-O 3.47Å; L394-V418 PolarHBondContact O-N 3.18Å; L394-V420 HydrophobicContact CB-CG2 4.45Å; L394-V420 HydrophobicContact CD1-CB 4.42Å; L394-V420 HydrophobicContact CD1-CG2 3.82Å; L394-V420 HydrophobicContact CG-CB 4.48Å; L394-V420 HydrophobicContact CG-CG2 3.91Å
395	R	97.9	Very high	95.5	Very high	79 Å²	79	38.4 Å²	38.4	30%	0.298	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	110.9	168.1	174	171.1	175.3	142.7	-1.3	108.9	L360 L362 E397 W415	L360-R395 PolarHBondContact O-N 2.86Å; L362-R395 HydrophobicContact CD1-CB 4.02Å; L362-R395 HydrophobicContact CD2-CB 4.16Å; L362-R395 HydrophobicContact CG-CB 4.02Å; R395-E397 IonicContact CZ-OE1 3.56Å; R395-E397 IonicContact NE-OE1 2.75Å; R395-E397 PolarHBondContact NE-OE1 3.04Å; R395-E397 IonicContact NH2-OE1 2.78Å; R395-E397 PolarHBondContact NH2-OE1 2.83Å; R395-W415 HydrophobicContact CB-CE3 4.33Å; R395-W415 HydrophobicContact CG-CB 4.19Å; R395-W415 HydrophobicContact CG-CD2 3.9Å; R395-W415 HydrophobicContact CG-CE3 3.69Å; R395-W415 HydrophobicContact CG-CG 4.12Å; R395-W415 HydrophobicContact CG-CZ3 4.37Å
396	L	97.8	Very high	95.1	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	111.6	177.2	-177.8	62.2	0	0	0	110.5	E295 A298 V299 I302 V401 L405 W415 R416 V418	E295-L396 HydrophobicContact CB-CD2 3.73Å; E295-L396 HydrophobicContact CG-CD2 3.86Å; A298-L396 HydrophobicContact CB-CD1 3.95Å; V299-L396 HydrophobicContact CG2-CD1 4.25Å; V299-L396 HydrophobicContact CG2-CD2 4.14Å; I302-L396 HydrophobicContact CD1-CD1 3.85Å; L396-V401 HydrophobicContact CD1-CG2 3.98Å; L396-V401 HydrophobicContact CD2-CG2 3.71Å; L396-V401 HydrophobicContact CG-CG2 3.83Å; L396-L405 HydrophobicContact CD2-CD2 3.96Å; L396-L405 HydrophobicContact CG-CD2 4.04Å; L396-W415 CarbonylContact O-C 3.54Å; L396-W415 WeakPolarHBondContact O-CA 3.35Å; L396-W415 WeakPolarHBondContact O-CB 3.32Å; L396-R416 PolarHBondContact N-O 3.46Å; L396-R416 PolarHBondContact O-N 2.73Å; L396-V418 HydrophobicContact CB-CG2 3.91Å; L396-V418 HydrophobicContact CD2-CG2 3.9Å
397	E	96.6	Very high	94	Very high	50 Å²	50	45.3 Å²	45.3	23%	0.234	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	133.6	174.3	-66.9	-64.3	159.9	0	0	110.8	R395 S399 R400	R395-E397 IonicContact CZ-OE1 3.56Å; R395-E397 IonicContact NE-OE1 2.75Å; R395-E397 PolarHBondContact NE-OE1 3.04Å; R395-E397 IonicContact NH2-OE1 2.78Å; R395-E397 PolarHBondContact NH2-OE1 2.83Å; E397-S399 PolarHBondContact O-N 2.86Å; E397-R400 HydrophobicContact CB-CG 4.4Å; E397-R400 WeakPolarHBondContact O-CB 3.27Å; E397-R400 PolarHBondContact O-N 3.21Å
398	G	94.4	Very high	93.1	Very high	11 Å²	11	47.2 Å²	47.2	11%	0.113	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-67.9	-20.4	-177.2	0	0	0	0	0	114.6	R400 V401 L405 G414	G398-R400 PolarHBondContact O-N 2.81Å; G398-V401 PolarHBondContact O-N 2.83Å; G398-L405 VanDerWaalsContact CA-CG 3.43Å; G398-G414 PolarHBondContact N-O 2.87Å
399	S	94.9	Very high	92	Very high	113 Å²	113	57 Å²	57	79%	0.79	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-66.1	-21	171.1	54	0	0	0	0	113.3	E397	E397-S399 PolarHBondContact O-N 2.86Å
400	R	95.2	Very high	91	Very high	102 Å²	102	60.1 Å²	60.1	39%	0.385	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-88.3	-3	176.8	-63.5	-174	176.6	-125.7	6.7	113.2	A298 E305 E397 G398	A298-R400 VanDerWaalsContact CB-O 3.22Å; A298-R400 WeakPolarHBondContact CB-O 3.05Å; E305-R400 IonicContact OE2-NH1 2.9Å; E305-R400 PolarHBondContact OE2-NH1 3.13Å; E397-R400 HydrophobicContact CB-CG 4.4Å; E397-R400 WeakPolarHBondContact O-CB 3.27Å; E397-R400 PolarHBondContact O-N 3.21Å; G398-R400 PolarHBondContact O-N 2.81Å
401	V	96.5	Very high	90.4	Very high	10 Å²	10	61.8 Å²	61.8	6%	0.061	35%	0.352	C	S	.	.	S	Bend	trans	-111.2	120.7	-173.6	-173.7	0	0	0	0	110.7	A294 E295 A298 L396 G398 G403 G404 L405	A294-V401 HydrophobicContact CB-CG1 4Å; E295-V401 HydrophobicContact CG-CG1 3.88Å; E295-V401 HydrophobicContact CG-CG2 4.3Å; A298-V401 HydrophobicContact CB-CG2 3.8Å; L396-V401 HydrophobicContact CD1-CG2 3.98Å; L396-V401 HydrophobicContact CD2-CG2 3.71Å; L396-V401 HydrophobicContact CG-CG2 3.83Å; G398-V401 PolarHBondContact O-N 2.83Å; V401-G403 PolarHBondContact O-N 3.32Å; V401-G404 VanDerWaalsContact CG1-O 3.28Å; V401-G404 WeakPolarHBondContact CG1-O 3.34Å; V401-G404 PolarHBondContact O-N 2.8Å; V401-L405 HydrophobicContact CB-CD2 4.28Å; V401-L405 HydrophobicContact CG2-CD2 3.62Å
402	E	92.8	Very high	89.7	Confident	145 Å²	145	63.2 Å²	63.2	68%	0.678	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	124	172	-172.8	-176.4	-164.4	0	0	110.3	R297 G404	R297-E402 IonicContact NH2-OE2 3.62Å; E402-G404 PolarHBondContact O-N 3.35Å
403	G	89.6	Confident	89.4	Confident	90 Å²	90	68.2 Å²	68.2	93%	0.928	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	1.2	-174.8	0	0	0	0	0	114.8	V401	V401-G403 PolarHBondContact O-N 3.32Å
404	G	90.8	Very high	89.1	Confident	29 Å²	29	69.5 Å²	69.5	30%	0.299	41%	0.413	S	S	.	.			trans	80.8	177	178.2	0	0	0	0	0	114.6	V401 E402	V401-G404 VanDerWaalsContact CG1-O 3.28Å; V401-G404 WeakPolarHBondContact CG1-O 3.34Å; V401-G404 PolarHBondContact O-N 2.8Å; E402-G404 PolarHBondContact O-N 3.35Å
405	L	90.4	Very high	89	Confident	20 Å²	20	71.1 Å²	71.1	11%	0.105	42%	0.419	C	S	.	.			trans	-75.1	153	179.6	-60.7	174.1	0	0	0	111.8	E295 L396 G398 V401 R407 R416	E295-L405 HydrophobicContact CG-CD2 4.22Å; L396-L405 HydrophobicContact CD2-CD2 3.96Å; L396-L405 HydrophobicContact CG-CD2 4.04Å; G398-L405 VanDerWaalsContact CA-CG 3.43Å; V401-L405 HydrophobicContact CB-CD2 4.28Å; V401-L405 HydrophobicContact CG2-CD2 3.62Å; L405-R407 HydrophobicContact CB-CG 4.2Å; L405-R407 PolarHBondContact O-N 3.46Å; L405-R416 HydrophobicContact CD1-CB 4.41Å; L405-R416 HydrophobicContact CD1-CG 4.16Å; L405-R416 HydrophobicContact CD2-CG 4.09Å
406	Q	81.1	Confident	88.9	Confident	69 Å²	69	67.5 Å²	67.5	32%	0.322	41%	0.405	S	S	.	.			trans	-67.2	108.2	154.9	-61.7	-157.1	-15.5	0	0	108.3	R289 A290 E295	R289-Q406 PolarHBondContact NH1-O 2.77Å; A290-Q406 PolarHBondContact O-OE1 2.88Å; E295-Q406 PolarHBondContact OE1-N 2.72Å
407	R	74.7	Confident	88.9	Confident	162 Å²	162	67.4 Å²	67.4	61%	0.611	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-95.7	143.2	-179.3	-65.7	-175.7	-178.2	-178.3	0.2	110.8	R289 L405	R289-R407 VanDerWaalsContact NH1-C 3.25Å; L405-R407 HydrophobicContact CB-CG 4.2Å; L405-R407 PolarHBondContact O-N 3.46Å
408	A	76.4	Confident	89	Confident	40 Å²	40	65.1 Å²	65.1	33%	0.331	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-78.1	148.8	164.3	0	0	0	0	0	107.7	G410 D411	A408-G410 PolarHBondContact O-N 2.88Å; A408-D411 HydrophobicContact CB-CB 4.26Å; A408-D411 PolarHBondContact O-N 3.04Å; A408-D411 VanDerWaalsContact O-N 3.07Å
409	Q	75.1	Confident	89.2	Confident	208 Å²	208	66.4 Å²	66.4	97%	0.972	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	123	177.3	-164	171.4	11.8	0	0	109.3
410	G	76.6	Confident	89.4	Confident	84 Å²	84	61 Å²	61	87%	0.866	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	0.4	-177.5	0	0	0	0	0	116.2	A408 G412	A408-G410 PolarHBondContact O-N 2.88Å; G410-G412 PolarHBondContact O-N 2.81Å
411	D	83.3	Confident	89.5	Confident	35 Å²	35	56.8 Å²	56.8	19%	0.187	34%	0.343	C	S	.	.			trans	-81.2	107	176.2	-169.9	0.9	0	0	0	111.9	R289 A408 R413	R289-D411 IonicContact NH2-OD2 3.73Å; A408-D411 HydrophobicContact CB-CB 4.26Å; A408-D411 PolarHBondContact O-N 3.04Å; A408-D411 VanDerWaalsContact O-N 3.07Å; D411-R413 WeakPolarHBondContact OD1-CB 3.33Å; D411-R413 WeakPolarHBondContact OD1-CG 3.37Å; D411-R413 IonicContact OD1-CZ 3.94Å; D411-R413 PolarHBondContact OD1-N 2.98Å; D411-R413 IonicContact OD1-NE 2.87Å; D411-R413 PolarHBondContact OD1-NE 3.11Å; D411-R413 IonicContact OD1-NH2 3.68Å; D411-R413 IonicContact OD2-CZ 3.67Å; D411-R413 IonicContact OD2-NE 2.84Å; D411-R413 IonicContact OD2-NH2 3.62Å; D411-R413 PolarHBondContact OD2-NH2 3.06Å
412	G	84.5	Confident	89.6	Confident	77 Å²	77	56.3 Å²	56.3	79%	0.794	34%	0.34	S	S	*	.			trans	-96.6	3.1	-179	0	0	0	0	0	115.4	G410 G414	G410-G412 PolarHBondContact O-N 2.81Å; G412-G414 VanDerWaalsContact C-N 3.26Å; G412-G414 PolarHBondContact O-N 2.88Å
413	R	91.8	Very high	89.9	Confident	105 Å²	105	49.4 Å²	49.4	40%	0.396	31%	0.308	S	S	.	.	S	Bend	trans	-66.4	-22.6	-171.1	-73.3	179.2	-66.4	156.3	-0.1	114.7	D286 D411 W415	D286-R413 VanDerWaalsContact CG-NH2 3.26Å; D286-R413 IonicContact OD1-CZ 3.69Å; D286-R413 IonicContact OD1-NH2 3.13Å; D286-R413 PolarHBondContact OD1-NH2 3.07Å; D286-R413 IonicContact OD2-CZ 3.32Å; D286-R413 IonicContact OD2-NH1 2.76Å; D286-R413 PolarHBondContact OD2-NH1 3.39Å; D286-R413 IonicContact OD2-NH2 3.99Å; D286-R413 PolarHBondContact OD2-NH2 3.28Å; D411-R413 WeakPolarHBondContact OD1-CB 3.33Å; D411-R413 WeakPolarHBondContact OD1-CG 3.37Å; D411-R413 IonicContact OD1-CZ 3.94Å; D411-R413 PolarHBondContact OD1-N 2.98Å; D411-R413 IonicContact OD1-NE 2.87Å; D411-R413 PolarHBondContact OD1-NE 3.11Å; D411-R413 IonicContact OD1-NH2 3.68Å; D411-R413 IonicContact OD2-CZ 3.67Å; D411-R413 IonicContact OD2-NE 2.84Å; D411-R413 IonicContact OD2-NH2 3.62Å; D411-R413 PolarHBondContact OD2-NH2 3.06Å; R413-W415 HydrophobicContact CB-CG 4.42Å; R413-W415 PolarHBondContact O-N 3.21Å
414	G	93	Very high	90.3	Very high	28 Å²	28	45.3 Å²	45.3	29%	0.289	27%	0.265	S	S	.	.	S	Bend	trans	76.4	-6.5	-175.3	0	0	0	0	0	114.8	G398 G412	G398-G414 PolarHBondContact N-O 2.87Å; G412-G414 VanDerWaalsContact C-N 3.26Å; G412-G414 PolarHBondContact O-N 2.88Å
415	W	95.4	Very high	90.6	Very high	36 Å²	36	43.9 Å²	43.9	14%	0.136	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	164	177.1	66.4	-88.4	0	0	0	111	L362 R395 L396 R413 A417	L362-W415 HydrophobicContact CD1-CH2 4.42Å; L362-W415 HydrophobicContact CD1-CZ3 3.81Å; R395-W415 HydrophobicContact CB-CE3 4.33Å; R395-W415 HydrophobicContact CG-CB 4.19Å; R395-W415 HydrophobicContact CG-CD2 3.9Å; R395-W415 HydrophobicContact CG-CE3 3.69Å; R395-W415 HydrophobicContact CG-CG 4.12Å; R395-W415 HydrophobicContact CG-CZ3 4.37Å; L396-W415 CarbonylContact O-C 3.54Å; L396-W415 WeakPolarHBondContact O-CA 3.35Å; L396-W415 WeakPolarHBondContact O-CB 3.32Å; R413-W415 HydrophobicContact CB-CG 4.42Å; R413-W415 PolarHBondContact O-N 3.21Å; W415-A417 HydrophobicContact CZ3-CB 4.43Å
416	R	96.4	Very high	90.8	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.008	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	156.9	168.3	69.1	178.6	-70.9	-162.9	-2.7	111.8	D286 R289 A290 E295 L396 L405 V418	D286-R416 HydrophobicContact CB-CB 4.32Å; D286-R416 PolarHBondContact O-NH2 2.93Å; R289-R416 PolarHBondContact O-NH2 2.76Å; A290-R416 PolarHBondContact O-NH1 2.91Å; A290-R416 PolarHBondContact O-NH2 2.77Å; E295-R416 VanDerWaalsContact OE1-CD 3.26Å; E295-R416 WeakPolarHBondContact OE1-CD 3.47Å; E295-R416 IonicContact OE1-CZ 2.66Å; E295-R416 IonicContact OE1-NE 3.89Å; E295-R416 IonicContact OE1-NH1 3.42Å; E295-R416 PolarHBondContact OE1-NH1 3.13Å; E295-R416 IonicContact OE2-NH1 3.41Å; E295-R416 PolarHBondContact OE2-NH1 3.45Å; L396-R416 PolarHBondContact N-O 3.46Å; L396-R416 PolarHBondContact O-N 2.73Å; L405-R416 HydrophobicContact CD1-CB 4.41Å; L405-R416 HydrophobicContact CD1-CG 4.16Å; L405-R416 HydrophobicContact CD2-CG 4.09Å; R416-V418 HydrophobicContact CG-CG2 4.14Å
417	A	97.7	Very high	91.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	138.1	169.4	0	0	0	0	0	111.7	H283 D286 I287 L362 I393 L394 W415	H283-A417 HydrophobicContact CB-CB 3.88Å; D286-A417 HydrophobicContact CB-CB 3.73Å; D286-A417 PolarHBondContact OD2-N 3.34Å; I287-A417 HydrophobicContact CG2-CB 4Å; L362-A417 HydrophobicContact CD1-CB 3.79Å; I393-A417 HydrophobicContact CG2-CB 3.64Å; L394-A417 CarbonylContact O-C 3.48Å; L394-A417 WeakPolarHBondContact O-CA 3.43Å; W415-A417 HydrophobicContact CZ3-CB 4.43Å
418	V	98.1	Very high	92.5	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.4	177.8	179.5	0	0	0	0	109.7	V291 V299 V332 I393 L394 L396 R416 V420	V291-V418 HydrophobicContact CG1-CG1 4.18Å; V291-V418 HydrophobicContact CG2-CG1 3.92Å; V299-V418 HydrophobicContact CG2-CB 4.42Å; V299-V418 HydrophobicContact CG2-CG1 4.12Å; V332-V418 HydrophobicContact CG2-CG1 4.02Å; I393-V418 WeakPolarHBondContact CA-O 3.49Å; L394-V418 PolarHBondContact N-O 3.47Å; L394-V418 PolarHBondContact O-N 3.18Å; L396-V418 HydrophobicContact CB-CG2 3.91Å; L396-V418 HydrophobicContact CD2-CG2 3.9Å; R416-V418 HydrophobicContact CG-CG2 4.14Å; V418-V420 HydrophobicContact CG1-CG2 4.37Å
419	R	98.4	Very high	93.4	Very high	38 Å²	38	38.5 Å²	38.5	14%	0.143	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	134.1	172.7	-72.5	-126.5	-50.3	119	5.8	110.6	F244 I287 D331 V332 L392 D421	F244-R419 VanDerWaalsContact CD2-CD 3.47Å; F244-R419 VanDerWaalsContact CE2-NH1 3.29Å; I287-R419 HydrophobicContact CB-CG 4.08Å; I287-R419 HydrophobicContact CG2-CG 4.12Å; D331-R419 WeakPolarHBondContact CA-O 3.3Å; D331-R419 HydrophobicContact CB-CB 3.77Å; D331-R419 IonicContact OD2-CZ 2.92Å; D331-R419 IonicContact OD2-NH2 2.72Å; D331-R419 PolarHBondContact OD2-NH2 3.23Å; V332-R419 PolarHBondContact N-O 3.24Å; L392-R419 WeakPolarHBondContact O-CA 3.47Å; R419-D421 IonicContact CZ-OD1 3.04Å; R419-D421 IonicContact NH1-OD1 3.63Å; R419-D421 PolarHBondContact NH1-OD1 3.38Å; R419-D421 IonicContact NH1-OD2 3.6Å; R419-D421 IonicContact NH2-OD1 2.83Å; R419-D421 IonicContact NH2-OD2 2.73Å
420	V	98.6	Very high	94.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.9	178.6	-173.5	0	0	0	0	109.5	V299 I303 V332 Y334 L392 L394 V418 L422	V299-V420 HydrophobicContact CG1-CG1 4.17Å; V299-V420 HydrophobicContact CG1-CG2 3.53Å; I303-V420 HydrophobicContact CD1-CG1 3.72Å; V332-V420 VanDerWaalsContact O-CA 3.3Å; V332-V420 WeakPolarHBondContact O-CA 3.32Å; V332-V420 WeakPolarHBondContact O-CG1 3.46Å; Y334-V420 HydrophobicContact CD2-CG1 4.2Å; L392-V420 WeakPolarHBondContact CA-O 3.32Å; L392-V420 HydrophobicContact CB-CB 4.29Å; L392-V420 WeakPolarHBondContact CB-O 3.26Å; L392-V420 PolarHBondContact N-O 2.87Å; L392-V420 PolarHBondContact O-N 3.3Å; L394-V420 HydrophobicContact CB-CG2 4.45Å; L394-V420 HydrophobicContact CD1-CB 4.42Å; L394-V420 HydrophobicContact CD1-CG2 3.82Å; L394-V420 HydrophobicContact CG-CB 4.48Å; L394-V420 HydrophobicContact CG-CG2 3.91Å; V418-V420 HydrophobicContact CG1-CG2 4.37Å; V420-L422 HydrophobicContact CG1-CD2 3.98Å; V420-L422 HydrophobicContact CG1-CG 4.4Å
421	D	98.5	Very high	95.3	Very high	14 Å²	14	30.3 Å²	30.3	8%	0.075	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.8	177.5	-64.1	-0.6	0	0	0	107.9	V332 D333 Y334 F391 R419 W437	V332-D421 PolarHBondContact O-N 3.45Å; D333-D421 WeakPolarHBondContact CA-O 3.46Å; Y334-D421 PolarHBondContact N-O 2.77Å; F391-D421 HydrophobicContact CD1-CB 4.22Å; F391-D421 WeakPolarHBondContact CD1-OD1 3.39Å; F391-D421 HydrophobicContact CE1-CB 4.47Å; R419-D421 IonicContact CZ-OD1 3.04Å; R419-D421 IonicContact NH1-OD1 3.63Å; R419-D421 PolarHBondContact NH1-OD1 3.38Å; R419-D421 IonicContact NH1-OD2 3.6Å; R419-D421 IonicContact NH2-OD1 2.83Å; R419-D421 IonicContact NH2-OD2 2.73Å; D421-W437 HydrophobicContact CB-CZ3 4.05Å
422	L	98.4	Very high	96	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.3	177.2	-56.5	-176.2	0	0	0	110.5	I303 Y334 L348 I351 K389 C390 L392 V420	I303-L422 HydrophobicContact CD1-CD2 4Å; I303-L422 HydrophobicContact CG2-CD1 4.42Å; I303-L422 HydrophobicContact CG2-CD2 4.47Å; Y334-L422 HydrophobicContact CD2-CD2 4.29Å; Y334-L422 HydrophobicContact CG-CD2 4.35Å; Y334-L422 WeakPolarHBondContact O-CA 3.5Å; L348-L422 HydrophobicContact CD2-CB 3.79Å; L348-L422 HydrophobicContact CD2-CD1 4.13Å; I351-L422 HydrophobicContact CG2-CD1 4.21Å; K389-L422 CarbonylContact C-O 3.5Å; K389-L422 WeakPolarHBondContact CA-O 3.45Å; K389-L422 WeakPolarHBondContact CB-O 3.41Å; C390-L422 PolarHBondContact N-O 3.5Å; C390-L422 PolarHBondContact O-N 3.23Å; L392-L422 HydrophobicContact CD1-CD1 3.79Å; L392-L422 HydrophobicContact CD1-CG 4.12Å; V420-L422 HydrophobicContact CG1-CD2 3.98Å; V420-L422 HydrophobicContact CG1-CG 4.4Å
423	V	98.3	Very high	96.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.4	168.5	65.4	0	0	0	0	110.5	Y334 V335 V336 F387 P425 T433 W437	Y334-V423 PolarHBondContact O-N 2.99Å; V335-V423 HydrophobicContact CB-CG1 4.14Å; V335-V423 HydrophobicContact CG1-CG1 4.33Å; V335-V423 HydrophobicContact CG2-CG1 3.57Å; V336-V423 PolarHBondContact N-O 2.93Å; F387-V423 HydrophobicContact CB-CG2 3.85Å; V423-P425 WeakPolarHBondContact O-CD 3.44Å; V423-T433 HydrophobicContact CG1-CG2 3.84Å; V423-T433 HydrophobicContact CG2-CG2 4.25Å; V423-W437 HydrophobicContact CB-CD2 4.2Å; V423-W437 HydrophobicContact CB-CH2 3.94Å; V423-W437 HydrophobicContact CB-CZ2 3.49Å; V423-W437 VanDerWaalsContact CB-CZ2 3.49Å; V423-W437 HydrophobicContact CB-CZ3 4.46Å; V423-W437 HydrophobicContact CG1-CD2 3.6Å; V423-W437 VanDerWaalsContact CG1-CE2 3.48Å; V423-W437 HydrophobicContact CG1-CE3 4.09Å; V423-W437 HydrophobicContact CG1-CG 3.95Å; V423-W437 HydrophobicContact CG1-CH2 4.33Å; V423-W437 HydrophobicContact CG1-CZ2 3.89Å; V423-W437 HydrophobicContact CG1-CZ3 4.42Å; V423-W437 HydrophobicContact CG2-CZ2 3.87Å
424	S	97.9	Very high	96.9	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.021	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	86.4	-177	-167.9	0	0	0	0	111.6	V336 E344 A388	V336-S424 WeakPolarHBondContact O-CA 3.24Å; V336-S424 PolarHBondContact O-OG 3.48Å; E344-S424 PolarHBondContact O-OG 2.94Å; E344-S424 VanDerWaalsContact O-OG 3.08Å; A388-S424 PolarHBondContact O-N 2.8Å
425	P	97.3	Very high	97.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.134	C	C	.	.			trans	-82.8	156.4	175.1	36.3	-36.8	0	0	0	111.3	V335 T337 F387 V423 R429 F430 T433	V335-P425 HydrophobicContact CG1-CG 3.7Å; T337-P425 WeakPolarHBondContact CB-O 3.38Å; T337-P425 PolarHBondContact OG1-O 3.24Å; F387-P425 HydrophobicContact CD1-CB 4.29Å; F387-P425 HydrophobicContact CD2-CB 3.68Å; F387-P425 HydrophobicContact CE1-CB 4.36Å; F387-P425 HydrophobicContact CE2-CB 3.76Å; F387-P425 HydrophobicContact CG-CB 3.96Å; F387-P425 HydrophobicContact CZ-CB 4.1Å; V423-P425 WeakPolarHBondContact O-CD 3.44Å; P425-R429 HydrophobicContact CB-CB 4.5Å; P425-F430 HydrophobicContact CG-CD2 4.44Å; P425-T433 HydrophobicContact CB-CG2 4.08Å; P425-T433 VanDerWaalsContact CB-OG1 3.24Å; P425-T433 WeakPolarHBondContact CB-OG1 3.39Å; P425-T433 HydrophobicContact CG-CG2 3.86Å
426	P	96.1	Very high	97.1	Very high	18 Å²	18	23.1 Å²	23.1	12%	0.117	13%	0.129	C	C	.	.			trans	-56.8	147.8	162.2	-22.1	33.3	0	0	0	111.3	L341 E344 F387 D428 R429 F430	L341-P426 HydrophobicContact CD2-CB 4.26Å; E344-P426 HydrophobicContact CG-CG 4.4Å; E344-P426 WeakPolarHBondContact OE1-CG 3.47Å; F387-P426 VanDerWaalsContact CD1-CD 3.49Å; F387-P426 HydrophobicContact CE1-CG 4.1Å; P426-D428 VanDerWaalsContact C-N 3.26Å; P426-D428 WeakPolarHBondContact CB-OD1 3.41Å; P426-D428 PolarHBondContact O-N 3.32Å; P426-R429 HydrophobicContact CB-CG 4.3Å; P426-R429 HydrophobicContact CG-CG 4.42Å; P426-R429 PolarHBondContact O-N 2.83Å; P426-F430 PolarHBondContact O-N 3.21Å
427	A	95.1	Very high	97.2	Very high	33 Å²	33	24.6 Å²	24.6	27%	0.273	14%	0.135	S	C	.	.	G	3₁₀ helix	trans	-56.9	-36.3	-175.5	0	0	0	0	0	113.6	T338 L341 R429 F430	T338-A427 WeakPolarHBondContact O-CB 3.36Å; L341-A427 HydrophobicContact CD2-CB 3.98Å; A427-R429 PolarHBondContact O-N 3.31Å; A427-F430 VanDerWaalsContact O-CB 3.28Å; A427-F430 WeakPolarHBondContact O-CB 3.46Å; A427-F430 PolarHBondContact O-N 2.7Å
428	D	94.8	Very high	97.2	Very high	82 Å²	82	25.4 Å²	25.4	44%	0.439	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-70.5	-14.8	177.9	69	-41.7	0	0	0	113.2	L341 P426	L341-D428 HydrophobicContact CD2-CB 4.24Å; P426-D428 VanDerWaalsContact C-N 3.26Å; P426-D428 WeakPolarHBondContact CB-OD1 3.41Å; P426-D428 PolarHBondContact O-N 3.32Å
429	R	95.8	Very high	97.1	Very high	44 Å²	44	25.9 Å²	25.9	17%	0.166	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-104.2	-3.8	177.5	-51.1	-58.9	162.1	171.7	1.2	113.6	F387 P425 P426 A427 A431 F432 T433 H462	F387-R429 HydrophobicContact CE1-CB 4.31Å; F387-R429 HydrophobicContact CE1-CG 4.35Å; F387-R429 HydrophobicContact CE2-CB 4.27Å; F387-R429 HydrophobicContact CZ-CB 3.56Å; F387-R429 HydrophobicContact CZ-CG 3.93Å; P425-R429 HydrophobicContact CB-CB 4.5Å; P426-R429 HydrophobicContact CB-CG 4.3Å; P426-R429 HydrophobicContact CG-CG 4.42Å; P426-R429 PolarHBondContact O-N 2.83Å; A427-R429 PolarHBondContact O-N 3.31Å; R429-A431 VanDerWaalsContact C-N 3.27Å; R429-A431 PolarHBondContact O-N 3.33Å; R429-A431 VanDerWaalsContact O-N 3.15Å; R429-F432 PolarHBondContact O-N 2.92Å; R429-F432 VanDerWaalsContact O-N 3.11Å; R429-T433 PolarHBondContact O-N 2.76Å; R429-T433 VanDerWaalsContact O-N 3.08Å; R429-T433 PolarHBondContact O-OG1 3.01Å; R429-H462 WeakPolarHBondContact CD-O 3.35Å
430	F	95.9	Very high	97	Very high	48 Å²	48	26.2 Å²	26.2	21%	0.211	15%	0.153	C	C	.	.	H	α-helix	trans	-51.6	-42.9	-175.5	-175.9	-97.2	0	0	0	113.1	I315 A317 V335 T337 P425 P426 A427 F432 T433 M434	I315-F430 HydrophobicContact CG2-CE2 3.94Å; I315-F430 HydrophobicContact CG2-CZ 3.81Å; A317-F430 HydrophobicContact CB-CZ 3.93Å; V335-F430 HydrophobicContact CB-CE2 4.3Å; V335-F430 HydrophobicContact CG1-CD2 3.75Å; V335-F430 HydrophobicContact CG1-CE2 3.54Å; T337-F430 HydrophobicContact CG2-CD2 3.47Å; T337-F430 VanDerWaalsContact CG2-CD2 3.47Å; T337-F430 HydrophobicContact CG2-CE2 3.85Å; T337-F430 HydrophobicContact CG2-CG 4.38Å; P425-F430 HydrophobicContact CG-CD2 4.44Å; P426-F430 PolarHBondContact O-N 3.21Å; A427-F430 VanDerWaalsContact O-CB 3.28Å; A427-F430 WeakPolarHBondContact O-CB 3.46Å; A427-F430 PolarHBondContact O-N 2.7Å; F430-F432 PolarHBondContact O-N 3.37Å; F430-T433 PolarHBondContact O-N 2.89Å; F430-M434 HydrophobicContact CD1-CG 3.76Å; F430-M434 HydrophobicContact CD2-CG 4.39Å; F430-M434 HydrophobicContact CE1-CG 3.4Å; F430-M434 VanDerWaalsContact CE1-CG 3.4Å; F430-M434 HydrophobicContact CE1-SD 4.16Å; F430-M434 HydrophobicContact CE2-CG 4.1Å; F430-M434 HydrophobicContact CE2-SD 4.26Å; F430-M434 HydrophobicContact CG-CG 4.25Å; F430-M434 HydrophobicContact CZ-CG 3.6Å; F430-M434 HydrophobicContact CZ-SD 3.78Å; F430-M434 VanDerWaalsContact O-CB 3.29Å; F430-M434 WeakPolarHBondContact O-CB 3.43Å; F430-M434 VanDerWaalsContact O-CG 3.24Å; F430-M434 WeakPolarHBondContact O-CG 3.29Å; F430-M434 PolarHBondContact O-N 3.4Å
431	A	96.7	Very high	96.8	Very high	72 Å²	72	35.7 Å²	35.7	60%	0.595	19%	0.189	S	C	*	.	H	α-helix	trans	-62.3	-43.6	-178.8	0	0	0	0	0	113.1	R429 L435	R429-A431 VanDerWaalsContact C-N 3.27Å; R429-A431 PolarHBondContact O-N 3.33Å; R429-A431 VanDerWaalsContact O-N 3.15Å; A431-L435 WeakPolarHBondContact O-CB 3.4Å; A431-L435 PolarHBondContact O-N 3.08Å
432	F	96.8	Very high	96.7	Very high	40 Å²	40	36.3 Å²	36.3	18%	0.175	19%	0.191	C	C	.	.	H	α-helix	trans	-69.3	-39.3	178	-60.5	-74.3	0	0	0	111.3	R429 F430 L435 G436 L459 N461 H462 L464	R429-F432 PolarHBondContact O-N 2.92Å; R429-F432 VanDerWaalsContact O-N 3.11Å; F430-F432 PolarHBondContact O-N 3.37Å; F432-L435 PolarHBondContact O-N 3.5Å; F432-G436 PolarHBondContact O-N 3.22Å; F432-L459 HydrophobicContact CD1-CD1 4.08Å; F432-L459 HydrophobicContact CE1-CD1 4.4Å; F432-N461 CarbonylContact C-O 3.36Å; F432-N461 VanDerWaalsContact C-O 3.26Å; F432-N461 WeakPolarHBondContact CB-O 3.35Å; F432-H462 WeakPolarHBondContact CD2-O 3.19Å; F432-L464 HydrophobicContact CE1-CB 3.72Å; F432-L464 HydrophobicContact CZ-CB 4.17Å
433	T	97.3	Very high	96.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-45.4	176.5	-50.9	0	0	0	0	110.9	V335 F387 V423 P425 R429 F430 L435 G436 W437 N461	V335-T433 HydrophobicContact CG1-CG2 4.27Å; V335-T433 HydrophobicContact CG2-CG2 4.02Å; F387-T433 HydrophobicContact CD2-CG2 4.31Å; F387-T433 WeakPolarHBondContact CE2-OG1 3.11Å; V423-T433 HydrophobicContact CG1-CG2 3.84Å; V423-T433 HydrophobicContact CG2-CG2 4.25Å; P425-T433 HydrophobicContact CB-CG2 4.08Å; P425-T433 VanDerWaalsContact CB-OG1 3.24Å; P425-T433 WeakPolarHBondContact CB-OG1 3.39Å; P425-T433 HydrophobicContact CG-CG2 3.86Å; R429-T433 PolarHBondContact O-N 2.76Å; R429-T433 VanDerWaalsContact O-N 3.08Å; R429-T433 PolarHBondContact O-OG1 3.01Å; F430-T433 PolarHBondContact O-N 2.89Å; T433-L435 VanDerWaalsContact C-N 3.32Å; T433-L435 PolarHBondContact O-N 3.08Å; T433-G436 PolarHBondContact O-N 3.28Å; T433-W437 HydrophobicContact CG2-CG 4.38Å; T433-W437 WeakPolarHBondContact O-CB 3.38Å; T433-W437 PolarHBondContact O-N 3.18Å; T433-N461 WeakPolarHBondContact CA-O 3.49Å; T433-N461 PolarHBondContact N-O 3.07Å; T433-N461 VanDerWaalsContact N-O 3.11Å; T433-N461 PolarHBondContact OG1-O 2.92Å
434	M	97.7	Very high	96.7	Very high	21 Å²	21	40.5 Å²	40.5	10%	0.103	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-44.2	175.1	-79.3	-61.7	-63.9	0	0	111.8	A317 T319 V335 F430 G436 T438	A317-M434 HydrophobicContact CB-CE 3.84Å; A317-M434 HydrophobicContact CB-SD 3.62Å; T319-M434 HydrophobicContact CG2-CE 3.82Å; T319-M434 HydrophobicContact CG2-SD 3.55Å; T319-M434 VanDerWaalsContact CG2-SD 3.55Å; V335-M434 HydrophobicContact CB-SD 3.83Å; V335-M434 HydrophobicContact CG1-SD 4.34Å; V335-M434 HydrophobicContact CG2-SD 3.76Å; F430-M434 HydrophobicContact CD1-CG 3.76Å; F430-M434 HydrophobicContact CD2-CG 4.39Å; F430-M434 HydrophobicContact CE1-CG 3.4Å; F430-M434 VanDerWaalsContact CE1-CG 3.4Å; F430-M434 HydrophobicContact CE1-SD 4.16Å; F430-M434 HydrophobicContact CE2-CG 4.1Å; F430-M434 HydrophobicContact CE2-SD 4.26Å; F430-M434 HydrophobicContact CG-CG 4.25Å; F430-M434 HydrophobicContact CZ-CG 3.6Å; F430-M434 HydrophobicContact CZ-SD 3.78Å; F430-M434 VanDerWaalsContact O-CB 3.29Å; F430-M434 WeakPolarHBondContact O-CB 3.43Å; F430-M434 VanDerWaalsContact O-CG 3.24Å; F430-M434 WeakPolarHBondContact O-CG 3.29Å; F430-M434 PolarHBondContact O-N 3.4Å; M434-G436 VanDerWaalsContact C-N 3.34Å; M434-G436 PolarHBondContact O-N 3.47Å; M434-T438 WeakPolarHBondContact O-CB 3.34Å; M434-T438 PolarHBondContact O-N 2.87Å; M434-T438 PolarHBondContact O-OG1 3.33Å
435	L	97.1	Very high	96.6	Very high	66 Å²	66	41 Å²	41	35%	0.346	21%	0.211	S	C	.	.	H	α-helix	trans	-60	-45.6	176.8	175.4	60.8	0	0	0	111.4	A431 F432 T433 F443 L447 L459	A431-L435 WeakPolarHBondContact O-CB 3.4Å; A431-L435 PolarHBondContact O-N 3.08Å; F432-L435 PolarHBondContact O-N 3.5Å; T433-L435 VanDerWaalsContact C-N 3.32Å; T433-L435 PolarHBondContact O-N 3.08Å; L435-F443 HydrophobicContact CD1-CE1 4.42Å; L435-L447 HydrophobicContact CD1-CD2 3.86Å; L435-L447 HydrophobicContact CD2-CD2 3.77Å; L435-L447 HydrophobicContact CG-CD2 4.02Å; L435-L459 HydrophobicContact CD2-CD2 4.48Å
436	G	96.6	Very high	96.7	Very high	3 Å²	3	41 Å²	41	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-57.6	179.8	0	0	0	0	0	112.7	F432 T433 M434 T438 G439 E444 N461	F432-G436 PolarHBondContact O-N 3.22Å; T433-G436 PolarHBondContact O-N 3.28Å; M434-G436 VanDerWaalsContact C-N 3.34Å; M434-G436 PolarHBondContact O-N 3.47Å; G436-T438 PolarHBondContact O-N 2.99Å; G436-T438 VanDerWaalsContact O-N 3.14Å; G436-G439 PolarHBondContact O-N 2.93Å; G436-E444 WeakPolarHBondContact CA-OE1 3.44Å; G436-N461 WeakPolarHBondContact CA-OD1 3.2Å
437	W	97.5	Very high	96.8	Very high	34 Å²	34	41.8 Å²	41.8	13%	0.129	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-19	-178.2	-76.7	73.4	0	0	0	113.7	T319 G320 D333 V335 D385 D421 V423 T433 G439	T319-W437 HydrophobicContact CG2-CB 4.24Å; G320-W437 WeakPolarHBondContact CA-O 3.3Å; G320-W437 PolarHBondContact N-O 2.88Å; D333-W437 HydrophobicContact CB-CE3 4.26Å; V335-W437 HydrophobicContact CG2-CB 4.09Å; V335-W437 HydrophobicContact CG2-CG 4.35Å; D385-W437 VanDerWaalsContact OD2-CE2 3.31Å; D385-W437 VanDerWaalsContact OD2-CZ2 3.29Å; D385-W437 WeakPolarHBondContact OD2-CZ2 3.31Å; D385-W437 PolarHBondContact OD2-NE1 3.28Å; D421-W437 HydrophobicContact CB-CZ3 4.05Å; V423-W437 HydrophobicContact CB-CD2 4.2Å; V423-W437 HydrophobicContact CB-CH2 3.94Å; V423-W437 HydrophobicContact CB-CZ2 3.49Å; V423-W437 VanDerWaalsContact CB-CZ2 3.49Å; V423-W437 HydrophobicContact CB-CZ3 4.46Å; V423-W437 HydrophobicContact CG1-CD2 3.6Å; V423-W437 VanDerWaalsContact CG1-CE2 3.48Å; V423-W437 HydrophobicContact CG1-CE3 4.09Å; V423-W437 HydrophobicContact CG1-CG 3.95Å; V423-W437 HydrophobicContact CG1-CH2 4.33Å; V423-W437 HydrophobicContact CG1-CZ2 3.89Å; V423-W437 HydrophobicContact CG1-CZ3 4.42Å; V423-W437 HydrophobicContact CG2-CZ2 3.87Å; T433-W437 HydrophobicContact CG2-CG 4.38Å; T433-W437 WeakPolarHBondContact O-CB 3.38Å; T433-W437 PolarHBondContact O-N 3.18Å; W437-G439 VanDerWaalsContact C-N 3.31Å
438	T	97.9	Very high	96.9	Very high	16 Å²	16	40.8 Å²	40.8	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-31.3	168.8	-64.7	0	0	0	0	112	R323 R324 M434 G436	R323-T438 WeakPolarHBondContact CD-OG1 3.3Å; R323-T438 PolarHBondContact NH1-OG1 3.29Å; R324-T438 VanDerWaalsContact CD-O 3.24Å; R324-T438 WeakPolarHBondContact CD-O 3.37Å; R324-T438 HydrophobicContact CG-CG2 4Å; R324-T438 WeakPolarHBondContact CG-O 3.4Å; R324-T438 PolarHBondContact NH1-O 3.49Å; M434-T438 WeakPolarHBondContact O-CB 3.34Å; M434-T438 PolarHBondContact O-N 2.87Å; M434-T438 PolarHBondContact O-OG1 3.33Å; G436-T438 PolarHBondContact O-N 2.99Å; G436-T438 VanDerWaalsContact O-N 3.14Å
439	G	95.9	Very high	97	Very high	11 Å²	11	37.6 Å²	37.6	11%	0.113	19%	0.186	C	C	.	.			trans	61.6	-156.5	-178.3	0	0	0	0	0	114	G436 W437	G436-G439 PolarHBondContact O-N 2.93Å; W437-G439 VanDerWaalsContact C-N 3.31Å
440	S	96.4	Very high	97.1	Very high	45 Å²	45	37.1 Å²	37.1	32%	0.315	19%	0.185	S	C	.	.			cis	-71.2	165.1	-2.4	72.6	0	0	0	0	113	M442 F443 E444	S440-M442 PolarHBondContact O-N 3.39Å; S440-M442 VanDerWaalsContact O-N 3.08Å; S440-F443 WeakPolarHBondContact O-CA 3.46Å; S440-F443 WeakPolarHBondContact O-CB 3.44Å; S440-F443 PolarHBondContact O-N 3.17Å; S440-F443 PolarHBondContact OG-N 2.89Å; S440-E444 PolarHBondContact O-N 2.98Å
441	R	95	Very high	97.2	Very high	200 Å²	200	35.2 Å²	35.2	76%	0.755	18%	0.178	S	C	*	.	H	α-helix	trans	-46.1	-43.2	175.9	-69.8	-171.2	-83.1	173.8	-5.7	113.4	R445	R441-R445 VanDerWaalsContact O-CB 3.28Å; R441-R445 WeakPolarHBondContact O-CB 3.41Å; R441-R445 PolarHBondContact O-N 2.71Å; R441-R445 VanDerWaalsContact O-N 3.15Å
442	M	96.7	Very high	97.2	Very high	26 Å²	26	35 Å²	35	13%	0.128	16%	0.161	C	C	.	.	H	α-helix	trans	-73.4	-33.2	178.4	-81.3	-60.2	-56.8	0	0	113.5	R180 R181 S440 D446	R180-M442 HydrophobicContact CB-CG 4.39Å; R180-M442 HydrophobicContact CB-SD 3.79Å; R181-M442 HydrophobicContact CB-CE 4.46Å; R181-M442 HydrophobicContact CG-CE 3.77Å; S440-M442 PolarHBondContact O-N 3.39Å; S440-M442 VanDerWaalsContact O-N 3.08Å; M442-D446 PolarHBondContact O-N 3.21Å; M442-D446 VanDerWaalsContact O-N 3.13Å
443	F	97.8	Very high	97.2	Very high	65 Å²	65	37 Å²	37	29%	0.285	17%	0.174	S	C	.	.	H	α-helix	trans	-66.2	-50.6	176	-177.4	-88.6	0	0	0	110.8	C143 L435 S440 R445 D446 L447	C143-F443 HydrophobicContact CB-CE2 4.16Å; C143-F443 HydrophobicContact CB-CZ 4.21Å; L435-F443 HydrophobicContact CD1-CE1 4.42Å; S440-F443 WeakPolarHBondContact O-CA 3.46Å; S440-F443 WeakPolarHBondContact O-CB 3.44Å; S440-F443 PolarHBondContact O-N 3.17Å; S440-F443 PolarHBondContact OG-N 2.89Å; F443-R445 PolarHBondContact O-N 3.49Å; F443-D446 PolarHBondContact O-N 3.39Å; F443-L447 HydrophobicContact CE1-CD2 4.06Å; F443-L447 VanDerWaalsContact O-CB 3.27Å; F443-L447 WeakPolarHBondContact O-CB 3.45Å; F443-L447 PolarHBondContact O-N 3.15Å
444	E	97.8	Very high	97.1	Very high	23 Å²	23	41.7 Å²	41.7	11%	0.107	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-47.4	177.3	-70.5	-176.5	89.1	0	0	111.8	G436 S440 D446 L447 R448 N461	G436-E444 WeakPolarHBondContact CA-OE1 3.44Å; S440-E444 PolarHBondContact O-N 2.98Å; E444-D446 VanDerWaalsContact C-N 3.33Å; E444-D446 PolarHBondContact O-N 3.44Å; E444-L447 WeakPolarHBondContact O-CB 3.44Å; E444-L447 PolarHBondContact O-N 2.88Å; E444-L447 VanDerWaalsContact O-N 3.11Å; E444-R448 WeakPolarHBondContact O-CG 3.41Å; E444-R448 PolarHBondContact O-N 2.92Å; E444-R448 IonicContact OE1-NH2 3.78Å; E444-R448 PolarHBondContact OE1-NH2 2.92Å; E444-N461 PolarHBondContact OE1-OD1 3.43Å
445	R	97.4	Very high	97.1	Very high	13 Å²	13	48.1 Å²	48.1	5%	0.049	22%	0.219	C	C	.	.	H	α-helix	trans	-57.9	-46.2	-179.6	-165.2	-174.2	71.7	94.5	-6.7	111.8	L177 R181 F381 E382 R441 F443 R449	L177-R445 VanDerWaalsContact CD2-NH1 3.3Å; R181-R445 VanDerWaalsContact NH2-NH1 3.18Å; F381-R445 HydrophobicContact CB-CG 3.58Å; E382-R445 WeakPolarHBondContact OE1-CD 3.48Å; R441-R445 VanDerWaalsContact O-CB 3.28Å; R441-R445 WeakPolarHBondContact O-CB 3.41Å; R441-R445 PolarHBondContact O-N 2.71Å; R441-R445 VanDerWaalsContact O-N 3.15Å; F443-R445 PolarHBondContact O-N 3.49Å; R445-R449 VanDerWaalsContact O-CB 3.28Å; R445-R449 WeakPolarHBondContact O-CB 3.33Å; R445-R449 PolarHBondContact O-N 2.97Å
446	D	97.9	Very high	97	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-73.8	-28.4	177.1	-90.7	-18.4	0	0	0	112.9	Y141 A142 M442 F443 E444 R449 F450	Y141-D446 HydrophobicContact CD1-CB 4.45Å; A142-D446 HydrophobicContact CB-CB 3.91Å; A142-D446 PolarHBondContact N-OD2 3.46Å; M442-D446 PolarHBondContact O-N 3.21Å; M442-D446 VanDerWaalsContact O-N 3.13Å; F443-D446 PolarHBondContact O-N 3.39Å; E444-D446 VanDerWaalsContact C-N 3.33Å; E444-D446 PolarHBondContact O-N 3.44Å; D446-R449 PolarHBondContact O-N 2.89Å; D446-R449 IonicContact OD1-CZ 2.93Å; D446-R449 IonicContact OD1-NE 3.55Å; D446-R449 PolarHBondContact OD1-NE 3.29Å; D446-R449 IonicContact OD1-NH2 2.89Å; D446-R449 PolarHBondContact OD1-NH2 3.36Å; D446-F450 WeakPolarHBondContact O-CB 3.32Å; D446-F450 PolarHBondContact O-N 3.31Å
447	L	98	Very high	97.1	Very high	36 Å²	36	51.4 Å²	51.4	19%	0.188	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-47.5	174.1	-175.1	65.7	0	0	0	111.1	C143 L435 F443 E444 R449 F450 A451 L459	C143-L447 HydrophobicContact CB-CB 3.89Å; C143-L447 HydrophobicContact CB-CD1 3.54Å; C143-L447 HydrophobicContact CB-CG 4.3Å; L435-L447 HydrophobicContact CD1-CD2 3.86Å; L435-L447 HydrophobicContact CD2-CD2 3.77Å; L435-L447 HydrophobicContact CG-CD2 4.02Å; F443-L447 HydrophobicContact CE1-CD2 4.06Å; F443-L447 VanDerWaalsContact O-CB 3.27Å; F443-L447 WeakPolarHBondContact O-CB 3.45Å; F443-L447 PolarHBondContact O-N 3.15Å; E444-L447 WeakPolarHBondContact O-CB 3.44Å; E444-L447 PolarHBondContact O-N 2.88Å; E444-L447 VanDerWaalsContact O-N 3.11Å; L447-R449 VanDerWaalsContact C-N 3.33Å; L447-R449 PolarHBondContact O-N 2.97Å; L447-F450 PolarHBondContact O-N 2.65Å; L447-A451 WeakPolarHBondContact O-CB 2.96Å; L447-A451 PolarHBondContact O-N 3.46Å; L447-L459 HydrophobicContact CD2-CD2 3.78Å; L447-L459 HydrophobicContact CG-CD2 3.66Å
448	R	98	Very high	97	Very high	11 Å²	11	50 Å²	50	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-38.2	174.5	-60.7	-178.9	-164.7	174.5	5.5	111.4	F381 A383 E444 R452 L459 N461	F381-R448 HydrophobicContact CD1-CB 3.96Å; F381-R448 PolarHBondContact O-NH1 3.41Å; A383-R448 PolarHBondContact O-NH1 3.42Å; A383-R448 PolarHBondContact O-NH2 3.49Å; A383-R448 VanDerWaalsContact O-NH2 3.08Å; E444-R448 WeakPolarHBondContact O-CG 3.41Å; E444-R448 PolarHBondContact O-N 2.92Å; E444-R448 IonicContact OE1-NH2 3.78Å; E444-R448 PolarHBondContact OE1-NH2 2.92Å; R448-R452 WeakPolarHBondContact O-CB 3.27Å; R448-R452 PolarHBondContact O-N 3.3Å; R448-L459 WeakPolarHBondContact CD-O 3.45Å; R448-L459 HydrophobicContact CG-CB 4.47Å; R448-L459 HydrophobicContact CG-CD2 4.46Å; R448-L459 HydrophobicContact CG-CG 4.41Å; R448-L459 VanDerWaalsContact CG-O 3.29Å; R448-L459 WeakPolarHBondContact CG-O 3.49Å; R448-N461 PolarHBondContact NH2-OD1 3.39Å
449	R	97.6	Very high	97	Very high	16 Å²	16	50.1 Å²	50.1	6%	0.06	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-46	173.9	-169.9	178.2	67.2	105.9	-8.5	112.1	Q140 Y141 F381 R445 D446 L447 R452 L453	Q140-R449 PolarHBondContact O-NH2 3.2Å; Y141-R449 VanDerWaalsContact CD1-CZ 3.48Å; Y141-R449 VanDerWaalsContact CD1-NH2 3.3Å; Y141-R449 HydrophobicContact CE1-CB 4.31Å; Y141-R449 HydrophobicContact CE1-CG 3.96Å; F381-R449 HydrophobicContact CD1-CB 4.28Å; F381-R449 HydrophobicContact CE1-CB 3.87Å; F381-R449 HydrophobicContact CE1-CG 4.26Å; F381-R449 HydrophobicContact CE2-CB 4.29Å; F381-R449 HydrophobicContact CE2-CG 4.08Å; F381-R449 HydrophobicContact CZ-CB 3.8Å; F381-R449 HydrophobicContact CZ-CG 3.69Å; R445-R449 VanDerWaalsContact O-CB 3.28Å; R445-R449 WeakPolarHBondContact O-CB 3.33Å; R445-R449 PolarHBondContact O-N 2.97Å; D446-R449 PolarHBondContact O-N 2.89Å; D446-R449 IonicContact OD1-CZ 2.93Å; D446-R449 IonicContact OD1-NE 3.55Å; D446-R449 PolarHBondContact OD1-NE 3.29Å; D446-R449 IonicContact OD1-NH2 2.89Å; D446-R449 PolarHBondContact OD1-NH2 3.36Å; L447-R449 VanDerWaalsContact C-N 3.33Å; L447-R449 PolarHBondContact O-N 2.97Å; R449-R452 PolarHBondContact O-N 3.04Å; R449-L453 HydrophobicContact CG-CD1 3.66Å; R449-L453 HydrophobicContact CG-CG 4.19Å; R449-L453 WeakPolarHBondContact O-CB 3.35Å; R449-L453 WeakPolarHBondContact O-CG 3.34Å; R449-L453 PolarHBondContact O-N 3.35Å
450	F	97.8	Very high	97	Very high	33 Å²	33	50 Å²	50	15%	0.145	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-48.1	178	178.7	-96.4	0	0	0	111.2	Y141 Q144 D446 L447 R452 L453 E454 R455	Y141-F450 HydrophobicContact CD1-CB 3.72Å; Y141-F450 HydrophobicContact CD1-CD2 4.21Å; Y141-F450 HydrophobicContact CD1-CG 4.48Å; Y141-F450 AromaticContact CD2-CD2 3.71Å; Y141-F450 HydrophobicContact CD2-CD2 3.71Å; Y141-F450 HydrophobicContact CD2-CE2 4.43Å; Y141-F450 HydrophobicContact CE1-CB 4.03Å; Y141-F450 HydrophobicContact CE1-CD2 4.41Å; Y141-F450 AromaticContact CE2-CD2 3.96Å; Y141-F450 HydrophobicContact CE2-CD2 3.96Å; Y141-F450 HydrophobicContact CG-CB 4.11Å; Y141-F450 AromaticContact CG-CD2 3.86Å; Y141-F450 HydrophobicContact CG-CD2 3.86Å; Y141-F450 HydrophobicContact CG-CG 4.44Å; Q144-F450 HydrophobicContact CG-CE2 4.38Å; D446-F450 WeakPolarHBondContact O-CB 3.32Å; D446-F450 PolarHBondContact O-N 3.31Å; L447-F450 PolarHBondContact O-N 2.65Å; F450-R452 VanDerWaalsContact C-N 3.25Å; F450-R452 PolarHBondContact O-N 3.16Å; F450-L453 PolarHBondContact O-N 3.13Å; F450-E454 HydrophobicContact CD2-CB 3.78Å; F450-E454 HydrophobicContact CD2-CG 3.47Å; F450-E454 VanDerWaalsContact CD2-CG 3.47Å; F450-E454 HydrophobicContact CE2-CB 3.61Å; F450-E454 HydrophobicContact CE2-CG 3.62Å; F450-E454 HydrophobicContact CG-CB 4.33Å; F450-E454 HydrophobicContact CG-CG 4.27Å; F450-E454 HydrophobicContact CZ-CB 4.04Å; F450-E454 WeakPolarHBondContact O-CA 3.4Å; F450-E454 WeakPolarHBondContact O-CB 3.44Å; F450-E454 PolarHBondContact O-N 2.84Å; F450-R455 HydrophobicContact CD1-CG 4.18Å; F450-R455 HydrophobicContact CE1-CG 3.73Å; F450-R455 HydrophobicContact CZ-CG 4.36Å; F450-R455 PolarHBondContact O-N 2.92Å
451	A	97.3	Very high	97	Very high	8 Å²	8	48 Å²	48	7%	0.066	21%	0.21	C	C	.	.	H	α-helix	trans	-53.4	-46	175.4	0	0	0	0	0	111.1	L447 R455 Q456 M457 L459	L447-A451 WeakPolarHBondContact O-CB 2.96Å; L447-A451 PolarHBondContact O-N 3.46Å; A451-R455 CarbonylContact O-C 3.59Å; A451-R455 WeakPolarHBondContact O-CA 3.33Å; A451-R455 VanDerWaalsContact O-CB 3.29Å; A451-R455 WeakPolarHBondContact O-CB 3.47Å; A451-R455 PolarHBondContact O-N 3.41Å; A451-Q456 PolarHBondContact O-N 3.24Å; A451-Q456 VanDerWaalsContact O-N 3.17Å; A451-M457 CarbonylContact C-O 3.51Å; A451-M457 HydrophobicContact CB-CB 4.27Å; A451-M457 PolarHBondContact O-N 2.95Å; A451-L459 HydrophobicContact CB-CB 3.98Å
452	R	96.4	Very high	97	Very high	67 Å²	67	38.8 Å²	38.8	25%	0.253	18%	0.175	S	C	.	.	H	α-helix	trans	-70.4	-50	-179	-169.3	170.7	77.3	-172.3	9.1	114.2	H379 F381 R448 R449 F450 M457 L458	H379-R452 PolarHBondContact O-NH1 3.01Å; F381-R452 HydrophobicContact CE1-CB 4.42Å; F381-R452 VanDerWaalsContact CE2-NH2 3.29Å; R448-R452 WeakPolarHBondContact O-CB 3.27Å; R448-R452 PolarHBondContact O-N 3.3Å; R449-R452 PolarHBondContact O-N 3.04Å; F450-R452 VanDerWaalsContact C-N 3.25Å; F450-R452 PolarHBondContact O-N 3.16Å; R452-M457 WeakPolarHBondContact CA-O 3.42Å; R452-M457 PolarHBondContact N-O 3.34Å; R452-L458 HydrophobicContact CG-CD2 4.32Å
453	L	96.3	Very high	97	Very high	84 Å²	84	37.8 Å²	37.8	44%	0.44	17%	0.171	S	C	.	.	H	α-helix	trans	-84.5	-35.6	-169.4	-59.9	-174.8	0	0	0	112.5	R449 F450	R449-L453 HydrophobicContact CG-CD1 3.66Å; R449-L453 HydrophobicContact CG-CG 4.19Å; R449-L453 WeakPolarHBondContact O-CB 3.35Å; R449-L453 WeakPolarHBondContact O-CG 3.34Å; R449-L453 PolarHBondContact O-N 3.35Å; F450-L453 PolarHBondContact O-N 3.13Å
454	E	97	Very high	96.9	Very high	98 Å²	98	36.2 Å²	36.2	46%	0.458	17%	0.165	S	C	.	.	H	α-helix	trans	-104.6	-21.3	-172.8	-51.3	-62.9	164.1	0	0	112.9	Y141 F450	Y141-E454 HydrophobicContact CE2-CG 3.78Å; Y141-E454 WeakPolarHBondContact CE2-OE1 3.48Å; Y141-E454 VanDerWaalsContact CZ-OE1 3.3Å; Y141-E454 PolarHBondContact OH-OE1 3.33Å; F450-E454 HydrophobicContact CD2-CB 3.78Å; F450-E454 HydrophobicContact CD2-CG 3.47Å; F450-E454 VanDerWaalsContact CD2-CG 3.47Å; F450-E454 HydrophobicContact CE2-CB 3.61Å; F450-E454 HydrophobicContact CE2-CG 3.62Å; F450-E454 HydrophobicContact CG-CB 4.33Å; F450-E454 HydrophobicContact CG-CG 4.27Å; F450-E454 HydrophobicContact CZ-CB 4.04Å; F450-E454 WeakPolarHBondContact O-CA 3.4Å; F450-E454 WeakPolarHBondContact O-CB 3.44Å; F450-E454 PolarHBondContact O-N 2.84Å
455	R	96.1	Very high	96.9	Very high	155 Å²	155	36.1 Å²	36.1	59%	0.585	16%	0.164	S	C	*	.	H	α-helix	trans	-117.1	-2.2	-177	-55.6	-59.1	-147.9	-176.3	5.5	114.9	F450 A451 M457	F450-R455 HydrophobicContact CD1-CG 4.18Å; F450-R455 HydrophobicContact CE1-CG 3.73Å; F450-R455 HydrophobicContact CZ-CG 4.36Å; F450-R455 PolarHBondContact O-N 2.92Å; A451-R455 CarbonylContact O-C 3.59Å; A451-R455 WeakPolarHBondContact O-CA 3.33Å; A451-R455 VanDerWaalsContact O-CB 3.29Å; A451-R455 WeakPolarHBondContact O-CB 3.47Å; A451-R455 PolarHBondContact O-N 3.41Å; R455-M457 HydrophobicContact CB-CB 4.35Å; R455-M457 HydrophobicContact CB-CG 4.18Å; R455-M457 HydrophobicContact CB-SD 3.96Å; R455-M457 WeakPolarHBondContact O-CG 3.49Å; R455-M457 PolarHBondContact O-N 2.81Å
456	Q	96.3	Very high	96.8	Very high	100 Å²	100	35.9 Å²	35.9	47%	0.467	16%	0.164	S	C	.	.	S	Bend	trans	52.7	35.8	-173.5	-60.6	-61	-40.3	0	0	112.8	A451 K467	A451-Q456 PolarHBondContact O-N 3.24Å; A451-Q456 VanDerWaalsContact O-N 3.17Å; Q456-K467 WeakPolarHBondContact O-CB 3.18Å; Q456-K467 VanDerWaalsContact O-CG 3.25Å; Q456-K467 WeakPolarHBondContact O-CG 3.4Å; Q456-K467 PolarHBondContact O-N 3.42Å
457	M	97.1	Very high	96.7	Very high	39 Å²	39	39.6 Å²	39.6	19%	0.192	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	152.1	-179.4	-72.3	169.5	176.6	0	0	111.6	A451 R452 R455 L464 F465 D466 I473	A451-M457 CarbonylContact C-O 3.51Å; A451-M457 HydrophobicContact CB-CB 4.27Å; A451-M457 PolarHBondContact O-N 2.95Å; R452-M457 WeakPolarHBondContact CA-O 3.42Å; R452-M457 PolarHBondContact N-O 3.34Å; R455-M457 HydrophobicContact CB-CB 4.35Å; R455-M457 HydrophobicContact CB-CG 4.18Å; R455-M457 HydrophobicContact CB-SD 3.96Å; R455-M457 WeakPolarHBondContact O-CG 3.49Å; R455-M457 PolarHBondContact O-N 2.81Å; M457-L464 HydrophobicContact CB-CD1 3.78Å; M457-L464 HydrophobicContact CG-CD1 4.31Å; M457-L464 HydrophobicContact SD-CD1 4.15Å; M457-L464 HydrophobicContact SD-CD2 4.17Å; M457-L464 HydrophobicContact SD-CG 4.42Å; M457-F465 CarbonylContact C-O 3.5Å; M457-F465 WeakPolarHBondContact CA-O 3.47Å; M457-D466 HydrophobicContact CE-CB 4.22Å; M457-D466 WeakPolarHBondContact CE-OD2 3.36Å; M457-D466 HydrophobicContact CG-CB 4.38Å; M457-I473 HydrophobicContact CE-CD1 3.76Å; M457-I473 HydrophobicContact SD-CD1 4.43Å
458	L	97	Very high	96.5	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.1	168.4	-59.7	176.1	0	0	0	108.7	L376 P377 R452 L464 F465 K467	L376-L458 HydrophobicContact CB-CD1 4.42Å; P377-L458 HydrophobicContact CB-CB 3.87Å; P377-L458 HydrophobicContact CG-CB 4.18Å; R452-L458 HydrophobicContact CG-CD2 4.32Å; L458-L464 CarbonylContact O-C 3.56Å; L458-L464 WeakPolarHBondContact O-CA 3.5Å; L458-F465 HydrophobicContact CB-CB 4.36Å; L458-F465 HydrophobicContact CD1-CD1 4.47Å; L458-F465 PolarHBondContact N-O 3.37Å; L458-F465 PolarHBondContact O-N 3.03Å; L458-K467 HydrophobicContact CG-CG 4.46Å
459	L	96.8	Very high	96.4	Very high	18 Å²	18	49.5 Å²	49.5	9%	0.094	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.6	177.8	176	67.5	0	0	0	109	F432 L435 L447 R448 A451 L464	F432-L459 HydrophobicContact CD1-CD1 4.08Å; F432-L459 HydrophobicContact CE1-CD1 4.4Å; L435-L459 HydrophobicContact CD2-CD2 4.48Å; L447-L459 HydrophobicContact CD2-CD2 3.78Å; L447-L459 HydrophobicContact CG-CD2 3.66Å; R448-L459 WeakPolarHBondContact CD-O 3.45Å; R448-L459 HydrophobicContact CG-CB 4.47Å; R448-L459 HydrophobicContact CG-CD2 4.46Å; R448-L459 HydrophobicContact CG-CG 4.41Å; R448-L459 VanDerWaalsContact CG-O 3.29Å; R448-L459 WeakPolarHBondContact CG-O 3.49Å; A451-L459 HydrophobicContact CB-CB 3.98Å; L459-L464 HydrophobicContact CB-CD1 3.86Å; L459-L464 HydrophobicContact CD1-CB 4.21Å; L459-L464 HydrophobicContact CD1-CD1 4.11Å
460	D	96.4	Very high	96.2	Very high	10 Å²	10	53.9 Å²	53.9	5%	0.053	26%	0.26	C	S	.	.			trans	-142.4	-163.2	164.1	69.6	11.2	0	0	0	111	P377 S378 H462 A463	P377-D460 WeakPolarHBondContact CA-OD2 3.29Å; P377-D460 HydrophobicContact CB-CB 4.15Å; S378-D460 PolarHBondContact N-OD2 3.47Å; D460-H462 PolarHBondContact O-N 3.27Å; D460-H462 WeakPolarHBondContact OD1-CB 3.46Å; D460-H462 IonicContact OD1-CG 3.41Å; D460-H462 PolarHBondContact OD1-N 3.38Å; D460-H462 IonicContact OD1-ND1 3.21Å; D460-H462 PolarHBondContact OD1-ND1 3.46Å; D460-H462 IonicContact OD2-CE1 2.8Å; D460-H462 IonicContact OD2-ND1 2.74Å; D460-H462 PolarHBondContact OD2-ND1 2.93Å; D460-A463 PolarHBondContact N-O 3.04Å; D460-A463 PolarHBondContact OD1-N 2.97Å; D460-A463 VanDerWaalsContact OD1-N 3.12Å
461	N	96.3	Very high	96.1	Very high	3 Å²	3	56 Å²	56	2%	0.016	27%	0.273	C	S	.	.	S	Bend	trans	-75	-4.2	-176.4	-70.8	6.5	0	0	0	113.8	D385 F432 T433 G436 E444 R448	D385-N461 HydrophobicContact CB-CB 3.69Å; F432-N461 CarbonylContact C-O 3.36Å; F432-N461 VanDerWaalsContact C-O 3.26Å; F432-N461 WeakPolarHBondContact CB-O 3.35Å; T433-N461 WeakPolarHBondContact CA-O 3.49Å; T433-N461 PolarHBondContact N-O 3.07Å; T433-N461 VanDerWaalsContact N-O 3.11Å; T433-N461 PolarHBondContact OG1-O 2.92Å; G436-N461 WeakPolarHBondContact CA-OD1 3.2Å; E444-N461 PolarHBondContact OE1-OD1 3.43Å; R448-N461 PolarHBondContact NH2-OD1 3.39Å
462	H	96.1	Very high	95.8	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.028	29%	0.288	C	S	.	.	S	Bend	trans	-110.3	-43.5	-175.6	-33.5	89.9	0	0	0	111.4	F371 D385 H386 F387 R429 F432 D460	F371-H462 HydrophobicContact CD2-CB 4.1Å; F371-H462 AromaticContact CD2-CD2 3.59Å; F371-H462 AromaticContact CD2-CG 3.9Å; F371-H462 HydrophobicContact CE2-CB 3.48Å; F371-H462 VanDerWaalsContact CE2-CB 3.48Å; F371-H462 AromaticContact CE2-CD2 3.92Å; F371-H462 AromaticContact CE2-CG 3.78Å; F371-H462 HydrophobicContact CZ-CB 4.22Å; D385-H462 VanDerWaalsContact CA-NE2 3.26Å; D385-H462 WeakPolarHBondContact CA-NE2 3.26Å; H386-H462 AromaticContact CD2-CE1 3.45Å; H386-H462 PolarHBondContact CD2-CE1 2.71Å; H386-H462 VanDerWaalsContact CD2-CE1 3.45Å; H386-H462 AromaticContact CD2-NE2 3.62Å; H386-H462 AromaticContact CG-NE2 3.91Å; H386-H462 PolarHBondContact N-NE2 3.37Å; F387-H462 AromaticContact CD2-CD2 3.95Å; F387-H462 HydrophobicContact CE2-CB 4.29Å; F387-H462 AromaticContact CE2-CD2 3.46Å; F387-H462 VanDerWaalsContact CE2-CD2 3.46Å; F387-H462 WeakPolarHBondContact CE2-CD2 3.47Å; F387-H462 HydrophobicContact CZ-CB 3.91Å; F387-H462 AromaticContact CZ-CD2 3.5Å; R429-H462 WeakPolarHBondContact CD-O 3.35Å; F432-H462 WeakPolarHBondContact CD2-O 3.19Å; D460-H462 PolarHBondContact O-N 3.27Å; D460-H462 WeakPolarHBondContact OD1-CB 3.46Å; D460-H462 IonicContact OD1-CG 3.41Å; D460-H462 PolarHBondContact OD1-N 3.38Å; D460-H462 IonicContact OD1-ND1 3.21Å; D460-H462 PolarHBondContact OD1-ND1 3.46Å; D460-H462 IonicContact OD2-CE1 2.8Å; D460-H462 IonicContact OD2-ND1 2.74Å; D460-H462 PolarHBondContact OD2-ND1 2.93Å
463	A	95.8	Very high	95.2	Very high	5 Å²	5	62.2 Å²	62.2	4%	0.041	30%	0.304	C	S	.	.			trans	-158	170.7	-172.2	0	0	0	0	0	113.5	P377 D460 F472	P377-A463 HydrophobicContact CG-CB 4.29Å; D460-A463 PolarHBondContact N-O 3.04Å; D460-A463 PolarHBondContact OD1-N 2.97Å; D460-A463 VanDerWaalsContact OD1-N 3.12Å; A463-F472 HydrophobicContact CB-CD1 3.94Å; A463-F472 HydrophobicContact CB-CE1 4.19Å
464	L	96.1	Very high	95.1	Very high	31 Å²	31	61.2 Å²	61.2	16%	0.162	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.9	167.8	179.5	67.5	0	0	0	109.2	F432 M457 L458 L459 F472 I473	F432-L464 HydrophobicContact CE1-CB 3.72Å; F432-L464 HydrophobicContact CZ-CB 4.17Å; M457-L464 HydrophobicContact CB-CD1 3.78Å; M457-L464 HydrophobicContact CG-CD1 4.31Å; M457-L464 HydrophobicContact SD-CD1 4.15Å; M457-L464 HydrophobicContact SD-CD2 4.17Å; M457-L464 HydrophobicContact SD-CG 4.42Å; L458-L464 CarbonylContact O-C 3.56Å; L458-L464 WeakPolarHBondContact O-CA 3.5Å; L459-L464 HydrophobicContact CB-CD1 3.86Å; L459-L464 HydrophobicContact CD1-CB 4.21Å; L459-L464 HydrophobicContact CD1-CD1 4.11Å; L464-F472 WeakPolarHBondContact O-CA 3.19Å; L464-I473 HydrophobicContact CB-CB 4.35Å; L464-I473 HydrophobicContact CD2-CB 4.1Å; L464-I473 HydrophobicContact CD2-CD1 3.83Å; L464-I473 HydrophobicContact CD2-CG2 4.26Å; L464-I473 HydrophobicContact CG-CB 4.32Å; L464-I473 HydrophobicContact CG-CD1 4.22Å; L464-I473 PolarHBondContact O-N 3.42Å
465	F	96.7	Very high	95.1	Very high	21 Å²	21	59.2 Å²	59.2	9%	0.092	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.9	177.4	-179.7	-96.8	0	0	0	110.6	L376 P377 M457 L458 K467 V470 L471 F472	L376-F465 HydrophobicContact CD2-CD1 3.91Å; L376-F465 HydrophobicContact CD2-CD2 3.61Å; L376-F465 HydrophobicContact CD2-CE1 3.92Å; L376-F465 HydrophobicContact CD2-CE2 3.62Å; L376-F465 HydrophobicContact CD2-CG 3.75Å; L376-F465 HydrophobicContact CD2-CZ 3.78Å; P377-F465 HydrophobicContact CG-CB 3.85Å; M457-F465 CarbonylContact C-O 3.5Å; M457-F465 WeakPolarHBondContact CA-O 3.47Å; L458-F465 HydrophobicContact CB-CB 4.36Å; L458-F465 HydrophobicContact CD1-CD1 4.47Å; L458-F465 PolarHBondContact N-O 3.37Å; L458-F465 PolarHBondContact O-N 3.03Å; F465-K467 HydrophobicContact CD1-CG 4.18Å; F465-K467 HydrophobicContact CE1-CG 4.23Å; F465-V470 HydrophobicContact CZ-CG1 4.04Å; F465-L471 WeakPolarHBondContact CD2-O 3.37Å; F465-F472 HydrophobicContact CB-CD1 4.29Å; F465-F472 HydrophobicContact CB-CE1 4.35Å; F465-F472 HydrophobicContact CD2-CD1 4.15Å; F465-F472 HydrophobicContact CD2-CD2 4.05Å; F465-F472 HydrophobicContact CD2-CE1 4.22Å; F465-F472 HydrophobicContact CD2-CE2 4.09Å; F465-F472 HydrophobicContact CD2-CG 4.09Å; F465-F472 HydrophobicContact CD2-CZ 4.19Å; F465-F472 HydrophobicContact CE2-CD2 4.46Å; F465-F472 HydrophobicContact CE2-CE2 4.41Å
466	D	97	Very high	95	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.048	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113	176.3	-173.3	-35.6	0	0	0	109.7	M457 T468 K469 V470 L471 I473	M457-D466 HydrophobicContact CE-CB 4.22Å; M457-D466 WeakPolarHBondContact CE-OD2 3.36Å; M457-D466 HydrophobicContact CG-CB 4.38Å; D466-T468 VanDerWaalsContact C-N 3.3Å; D466-T468 PolarHBondContact O-N 2.96Å; D466-T468 WeakPolarHBondContact OD1-CA 3.38Å; D466-T468 WeakPolarHBondContact OD1-CB 3.46Å; D466-T468 PolarHBondContact OD1-N 3.32Å; D466-K469 HydrophobicContact CB-CB 4.19Å; D466-K469 PolarHBondContact OD1-N 3.4Å; D466-K469 WeakPolarHBondContact OD2-CD 3.47Å; D466-V470 VanDerWaalsContact O-CA 3.25Å; D466-V470 WeakPolarHBondContact O-CA 3.45Å; D466-V470 PolarHBondContact O-N 3.28Å; D466-L471 PolarHBondContact N-O 3.01Å; D466-L471 PolarHBondContact O-N 3.09Å; D466-I473 HydrophobicContact CB-CD1 3.98Å; D466-I473 HydrophobicContact CB-CG1 4.37Å
467	K	94.7	Very high	94.9	Very high	78 Å²	78	51.2 Å²	51.2	34%	0.339	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.7	-178.7	-60.4	-178.8	173	-169	0	113.2	Q456 L458 F465	Q456-K467 WeakPolarHBondContact O-CB 3.18Å; Q456-K467 VanDerWaalsContact O-CG 3.25Å; Q456-K467 WeakPolarHBondContact O-CG 3.4Å; Q456-K467 PolarHBondContact O-N 3.42Å; L458-K467 HydrophobicContact CG-CG 4.46Å; F465-K467 HydrophobicContact CD1-CG 4.18Å; F465-K467 HydrophobicContact CE1-CG 4.23Å
468	T	94.6	Very high	94.8	Very high	111 Å²	111	51.9 Å²	51.9	68%	0.681	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-41.2	179.6	-56.6	0	0	0	0	110.2	D466	D466-T468 VanDerWaalsContact C-N 3.3Å; D466-T468 PolarHBondContact O-N 2.96Å; D466-T468 WeakPolarHBondContact OD1-CA 3.38Å; D466-T468 WeakPolarHBondContact OD1-CB 3.46Å; D466-T468 PolarHBondContact OD1-N 3.32Å
469	K	95.6	Very high	94.6	Very high	143 Å²	143	55.1 Å²	55.1	62%	0.622	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-13.6	177.4	-61.6	-178.2	-175.4	175.8	0	113.9	D466 L471	D466-K469 HydrophobicContact CB-CB 4.19Å; D466-K469 PolarHBondContact OD1-N 3.4Å; D466-K469 WeakPolarHBondContact OD2-CD 3.47Å; K469-L471 VanDerWaalsContact C-N 3.35Å; K469-L471 HydrophobicContact CB-CD2 3.73Å; K469-L471 HydrophobicContact CB-CG 3.83Å; K469-L471 HydrophobicContact CD-CD2 4.28Å; K469-L471 PolarHBondContact O-N 3.23Å
470	V	93.9	Very high	94.5	Very high	109 Å²	109	57.8 Å²	57.8	66%	0.661	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	47.3	-177.9	-161.8	0	0	0	0	111.4	F465 D466	F465-V470 HydrophobicContact CZ-CG1 4.04Å; D466-V470 VanDerWaalsContact O-CA 3.25Å; D466-V470 WeakPolarHBondContact O-CA 3.45Å; D466-V470 PolarHBondContact O-N 3.28Å
471	L	94.6	Very high	94.3	Very high	78 Å²	78	61.5 Å²	61.5	41%	0.408	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	155	-179.9	67.2	85.5	0	0	0	112.8	F465 D466 K469 I473	F465-L471 WeakPolarHBondContact CD2-O 3.37Å; D466-L471 PolarHBondContact N-O 3.01Å; D466-L471 PolarHBondContact O-N 3.09Å; K469-L471 VanDerWaalsContact C-N 3.35Å; K469-L471 HydrophobicContact CB-CD2 3.73Å; K469-L471 HydrophobicContact CB-CG 3.83Å; K469-L471 HydrophobicContact CD-CD2 4.28Å; K469-L471 PolarHBondContact O-N 3.23Å; L471-I473 HydrophobicContact CD1-CG1 3.92Å
472	F	90.6	Very high	94.2	Very high	89 Å²	89	66.3 Å²	66.3	39%	0.39	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	133.7	168.5	-71.7	-86.2	0	0	0	110	L376 P377 A463 L464 F465	L376-F472 HydrophobicContact CD2-CE2 4.44Å; L376-F472 HydrophobicContact CD2-CZ 4Å; P377-F472 HydrophobicContact CG-CE1 4.32Å; A463-F472 HydrophobicContact CB-CD1 3.94Å; A463-F472 HydrophobicContact CB-CE1 4.19Å; L464-F472 WeakPolarHBondContact O-CA 3.19Å; F465-F472 HydrophobicContact CB-CD1 4.29Å; F465-F472 HydrophobicContact CB-CE1 4.35Å; F465-F472 HydrophobicContact CD2-CD1 4.15Å; F465-F472 HydrophobicContact CD2-CD2 4.05Å; F465-F472 HydrophobicContact CD2-CE1 4.22Å; F465-F472 HydrophobicContact CD2-CE2 4.09Å; F465-F472 HydrophobicContact CD2-CG 4.09Å; F465-F472 HydrophobicContact CD2-CZ 4.19Å; F465-F472 HydrophobicContact CE2-CD2 4.46Å; F465-F472 HydrophobicContact CE2-CE2 4.41Å
473	I	84.3	Confident	94	Very high	116 Å²	116	71.8 Å²	71.8	60%	0.595	37%	0.367	S	S	*	.			trans	-93.3	0	177.3	-64.2	175.5	0	0	0	110.1	M457 L464 D466 L471	M457-I473 HydrophobicContact CE-CD1 3.76Å; M457-I473 HydrophobicContact SD-CD1 4.43Å; L464-I473 HydrophobicContact CB-CB 4.35Å; L464-I473 HydrophobicContact CD2-CB 4.1Å; L464-I473 HydrophobicContact CD2-CD1 3.83Å; L464-I473 HydrophobicContact CD2-CG2 4.26Å; L464-I473 HydrophobicContact CG-CB 4.32Å; L464-I473 HydrophobicContact CG-CD1 4.22Å; L464-I473 PolarHBondContact O-N 3.42Å; D466-I473 HydrophobicContact CB-CD1 3.98Å; D466-I473 HydrophobicContact CB-CG1 4.37Å; L471-I473 HydrophobicContact CD1-CG1 3.92Å

Retrieved 473 of 473 residues in 290.5 ms (Link to these results)

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