X6R4J9_HUMAN Loading...

DAB adaptor protein 1

AlphaFold DB , UniProt , Accession X6R4J9, Species HUMAN (Homo sapiens, Human), Gene DAB1, Length 204 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	39.8	Very low	38.1	Very low	227 Å²	227	147.5 Å²	147.5	100%	1.118	82%	0.822	S	S	*	*				0	64.3	0	-51.3	-51.2	-154.4	0	0	107.2
2	S	41.1	Very low	38.1	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	82%	0.821	S	S	*	*				59.8	99.8	76.5	-47.5	0	0	0	0	111.9
3	T	39.8	Very low	37.7	Very low	143 Å²	143	149.3 Å²	149.3	88%	0.877	82%	0.82	S	S	*	*			trans	-162.4	114.9	131.7	43.6	0	0	0	0	109.1
4	E	39.2	Very low	37.6	Very low	187 Å²	187	145.9 Å²	145.9	87%	0.874	81%	0.812	S	S	*	*			trans	-68.6	150.6	164.4	-66.7	159.8	128.2	0	0	110.3
5	T	38.5	Very low	37.7	Very low	129 Å²	129	142.9 Å²	142.9	79%	0.791	81%	0.814	S	S	*	*			trans	-148.6	104	149.5	-43.8	0	0	0	0	109
6	E	39.8	Very low	37.8	Very low	159 Å²	159	145.9 Å²	145.9	74%	0.743	82%	0.815	S	S	*	*			trans	-62.2	133.2	162.8	-81	176.6	92.5	0	0	110.4
7	L	36.6	Very low	37.7	Very low	155 Å²	155	149.2 Å²	149.2	81%	0.812	82%	0.819	S	S	*	*			trans	-129.9	101.2	156.7	-91	160.6	0	0	0	108.7	V9	L7-V9 PolarHBondContact O-N 3.16Å
8	Q	36.4	Very low	37.6	Very low	167 Å²	167	148.6 Å²	148.6	78%	0.78	81%	0.814	S	S	*	*			trans	-65.8	123.2	166.9	-64.9	176.5	7.5	0	0	109.1
9	V	35.7	Very low	37.8	Very low	133 Å²	133	146.2 Å²	146.2	81%	0.806	81%	0.809	S	S	*	*			trans	-111.8	109	166.1	-179.3	0	0	0	0	108.2	L7 V11	L7-V9 PolarHBondContact O-N 3.16Å; V9-V11 PolarHBondContact O-N 2.87Å
10	A	38.9	Very low	38.2	Very low	83 Å²	83	150.3 Å²	150.3	69%	0.686	81%	0.811	S	S	*	*			trans	-55.9	123.8	178.6	0	0	0	0	0	112.2	K12	A10-K12 PolarHBondContact O-N 3.09Å; A10-K12 VanDerWaalsContact O-N 3.08Å
11	V	33.2	Very low	38.5	Very low	130 Å²	130	152.7 Å²	152.7	79%	0.788	82%	0.815	S	S	*	*			trans	-70	99.2	170.6	177.5	0	0	0	0	108.6	V9 T13	V9-V11 PolarHBondContact O-N 2.87Å; V11-T13 HydrophobicContact CG1-CG2 4.4Å; V11-T13 PolarHBondContact O-N 3.2Å
12	K	38.5	Very low	39	Very low	187 Å²	187	151.9 Å²	151.9	81%	0.813	81%	0.805	S	S	*	*			trans	-82.7	98.7	165.3	-72.5	-175.7	178.8	179	0	108.8	A10 S14	A10-K12 PolarHBondContact O-N 3.09Å; A10-K12 VanDerWaalsContact O-N 3.08Å; K12-S14 VanDerWaalsContact C-N 3.32Å; K12-S14 PolarHBondContact O-N 3.21Å
13	T	32.6	Very low	40.1	Very low	131 Å²	131	149.8 Å²	149.8	80%	0.804	80%	0.8	S	S	*	*			trans	-62.4	90.7	165.3	33.1	0	0	0	0	109.6	V11 A15	V11-T13 HydrophobicContact CG1-CG2 4.4Å; V11-T13 PolarHBondContact O-N 3.2Å; T13-A15 PolarHBondContact O-N 3.07Å
14	S	36	Very low	41.8	Very low	101 Å²	101	147.8 Å²	147.8	71%	0.706	78%	0.781	S	S	*	*			trans	-82.7	95.7	167	42.6	0	0	0	0	108.4	K12 K16	K12-S14 VanDerWaalsContact C-N 3.32Å; K12-S14 PolarHBondContact O-N 3.21Å; S14-K16 PolarHBondContact O-N 3.36Å
15	A	39.3	Very low	44.1	Very low	101 Å²	101	143.3 Å²	143.3	84%	0.835	76%	0.763	S	S	*	*			trans	-64.3	81.8	165.4	0	0	0	0	0	108.9	T13 K17	T13-A15 PolarHBondContact O-N 3.07Å; A15-K17 PolarHBondContact O-N 3.25Å
16	K	38.7	Very low	46.6	Very low	192 Å²	192	141.2 Å²	141.2	84%	0.835	74%	0.74	S	S	*	*			trans	-68.8	102.3	168.1	-105.2	178.2	176.8	173.6	0	107.3	S14 D18	S14-K16 PolarHBondContact O-N 3.36Å; K16-D18 VanDerWaalsContact C-N 3.31Å; K16-D18 PolarHBondContact O-N 3.49Å
17	K	35.9	Very low	49.2	Very low	202 Å²	202	136 Å²	136	88%	0.878	72%	0.721	S	S	*	*			trans	-49.9	95.4	164.8	-174.6	175.8	-177	175.7	0	108.6	A15 S19	A15-K17 PolarHBondContact O-N 3.25Å; K17-S19 PolarHBondContact O-N 3.07Å
18	D	36.8	Very low	51.9	Low	137 Å²	137	131.7 Å²	131.7	73%	0.733	70%	0.697	S	S	*	*			trans	-66.8	97.6	175.3	-152.4	-24.7	0	0	0	107.3	K16 R20	K16-D18 VanDerWaalsContact C-N 3.31Å; K16-D18 PolarHBondContact O-N 3.49Å; D18-R20 PolarHBondContact O-N 3.3Å
19	S	40.9	Very low	54.7	Low	103 Å²	103	126.5 Å²	126.5	72%	0.72	68%	0.683	S	S	*	*			trans	-68.2	81.4	171.1	56.8	0	0	0	0	107.4	K17 K21	K17-S19 PolarHBondContact O-N 3.07Å; S19-K21 PolarHBondContact O-N 3.06Å
20	R	45.2	Very low	57.5	Low	228 Å²	228	122.4 Å²	122.4	86%	0.86	66%	0.658	S	S	*	*			trans	-49.8	108	169.1	-71.9	179.6	-172.4	169.3	2.6	106.9	D18 K22	D18-R20 PolarHBondContact O-N 3.3Å; R20-K22 PolarHBondContact O-N 3.06Å
21	K	46.5	Very low	60.3	Low	202 Å²	202	119.2 Å²	119.2	88%	0.878	63%	0.63	S	S	*	*			trans	-46.7	114.2	163.5	-87.5	175.8	174.2	171.8	0	105.9	S19 G23	S19-K21 PolarHBondContact O-N 3.06Å; K21-G23 VanDerWaalsContact C-N 3.34Å; K21-G23 PolarHBondContact O-N 2.7Å
22	K	49	Very low	63.3	Low	210 Å²	210	115.6 Å²	115.6	91%	0.913	61%	0.605	S	S	*	*			trans	-57.5	101.1	179.7	-155.7	176	-174.9	-178.5	0	106.4	R20	R20-K22 PolarHBondContact O-N 3.06Å
23	G	64.1	Low	66.1	Low	65 Å²	65	114.8 Å²	114.8	67%	0.67	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-56.9	140.1	178.9	0	0	0	0	0	108.6	K21 D25	K21-G23 VanDerWaalsContact C-N 3.34Å; K21-G23 PolarHBondContact O-N 2.7Å; G23-D25 PolarHBondContact O-N 3.33Å
24	Q	76.5	Confident	69.2	Low	102 Å²	102	111.4 Å²	111.4	48%	0.477	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-58.3	131.7	173	-172.7	172.8	-7.2	0	0	108.8	R26 R34	Q24-R26 PolarHBondContact O-N 3Å; Q24-R34 VanDerWaalsContact NE2-NH1 3.17Å
25	D	86.3	Confident	72.1	Confident	92 Å²	92	106.6 Å²	106.6	49%	0.492	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-61.9	127.2	175.2	175	30.9	0	0	0	109.7	G23 S27 T30	G23-D25 PolarHBondContact O-N 3.33Å; D25-S27 WeakPolarHBondContact OD1-CB 3.42Å; D25-S27 PolarHBondContact OD1-N 3.26Å; D25-S27 VanDerWaalsContact OD1-N 3.07Å; D25-S27 PolarHBondContact OD1-OG 3.45Å; D25-S27 PolarHBondContact OD2-OG 3.21Å; D25-T30 HydrophobicContact CB-CG2 4.46Å; D25-T30 WeakPolarHBondContact O-CG2 3.27Å; D25-T30 WeakPolarHBondContact OD2-CB 3.34Å; D25-T30 PolarHBondContact OD2-OG1 3.44Å
26	R	90.9	Very high	74.8	Confident	85 Å²	85	109.1 Å²	109.1	32%	0.321	53%	0.533	S	S	.	.			trans	-118	25.4	-178	-65	-174.2	-176.7	-138.7	-0.1	112.3	Q24 D156	Q24-R26 PolarHBondContact O-N 3Å; R26-D156 WeakPolarHBondContact CD-OD2 3.43Å; R26-D156 IonicContact CZ-OD2 2.61Å; R26-D156 IonicContact NE-OD2 3.55Å; R26-D156 PolarHBondContact NE-OD2 2.9Å; R26-D156 IonicContact NH1-OD1 3.54Å; R26-D156 PolarHBondContact NH1-OD1 3.37Å; R26-D156 IonicContact NH1-OD2 2.76Å; R26-D156 PolarHBondContact NH1-OD2 3.07Å
27	S	94.1	Very high	77.5	Confident	49 Å²	49	103 Å²	103	34%	0.343	53%	0.525	S	S	.	.			trans	-60.8	149.6	170.2	64.8	0	0	0	0	111.8	D25 A29 T30 L31	D25-S27 WeakPolarHBondContact OD1-CB 3.42Å; D25-S27 PolarHBondContact OD1-N 3.26Å; D25-S27 VanDerWaalsContact OD1-N 3.07Å; D25-S27 PolarHBondContact OD1-OG 3.45Å; D25-S27 PolarHBondContact OD2-OG 3.21Å; S27-A29 VanDerWaalsContact C-N 3.28Å; S27-A29 PolarHBondContact O-N 3Å; S27-T30 PolarHBondContact O-N 3.13Å; S27-T30 WeakPolarHBondContact OG-CB 3.28Å; S27-T30 PolarHBondContact OG-OG1 2.93Å; S27-T30 VanDerWaalsContact OG-OG1 3.06Å; S27-L31 WeakPolarHBondContact O-CG 3.11Å; S27-L31 PolarHBondContact O-N 3.37Å
28	E	93.6	Very high	80.3	Confident	66 Å²	66	100.9 Å²	100.9	31%	0.308	52%	0.518	S	S	.	.	H	α-helix	trans	-49.8	-48.7	179.1	-177.7	-179.5	131.7	0	0	111.5	T30 L31 I32 L160 R167	E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.18Å; E28-L31 PolarHBondContact O-N 3.17Å; E28-I32 HydrophobicContact CG-CD1 3.88Å; E28-I32 HydrophobicContact CG-CG1 4.47Å; E28-I32 VanDerWaalsContact O-CG1 3.3Å; E28-I32 WeakPolarHBondContact O-CG1 3.34Å; E28-I32 PolarHBondContact O-N 2.9Å; E28-L160 HydrophobicContact CG-CD1 3.71Å; E28-R167 IonicContact OE1-CZ 3.72Å; E28-R167 IonicContact OE1-NH1 2.9Å; E28-R167 PolarHBondContact OE1-NH1 2.88Å; E28-R167 IonicContact OE1-NH2 3.62Å; E28-R167 IonicContact OE2-CZ 3.62Å; E28-R167 IonicContact OE2-NH1 3.53Å; E28-R167 IonicContact OE2-NH2 2.77Å; E28-R167 PolarHBondContact OE2-NH2 3.45Å
29	A	95	Very high	83.2	Confident	58 Å²	58	95.7 Å²	95.7	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-38.1	179.5	0	0	0	0	0	112.9	S27 K33	S27-A29 VanDerWaalsContact C-N 3.28Å; S27-A29 PolarHBondContact O-N 3Å; A29-K33 WeakPolarHBondContact O-CG 3.38Å; A29-K33 PolarHBondContact O-N 3.48Å
30	T	96.4	Very high	85.9	Confident	47 Å²	47	91.9 Å²	91.9	29%	0.288	47%	0.469	S	S	.	.	H	α-helix	trans	-70.6	-41.8	176.6	-67.6	0	0	0	0	111.1	D25 S27 E28 K33 R34	D25-T30 HydrophobicContact CB-CG2 4.46Å; D25-T30 WeakPolarHBondContact O-CG2 3.27Å; D25-T30 WeakPolarHBondContact OD2-CB 3.34Å; D25-T30 PolarHBondContact OD2-OG1 3.44Å; S27-T30 PolarHBondContact O-N 3.13Å; S27-T30 WeakPolarHBondContact OG-CB 3.28Å; S27-T30 PolarHBondContact OG-OG1 2.93Å; S27-T30 VanDerWaalsContact OG-OG1 3.06Å; E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.18Å; T30-K33 PolarHBondContact O-N 3.37Å; T30-R34 VanDerWaalsContact O-CB 3.24Å; T30-R34 WeakPolarHBondContact O-CB 3.48Å; T30-R34 PolarHBondContact O-N 2.86Å
31	L	96.8	Very high	88.4	Confident	15 Å²	15	87.2 Å²	87.2	8%	0.079	45%	0.451	C	S	.	.	H	α-helix	trans	-66.4	-39.9	177.4	-63.9	178.8	0	0	0	112.2	S27 E28 K33 R34 F35 D156 L160	S27-L31 WeakPolarHBondContact O-CG 3.11Å; S27-L31 PolarHBondContact O-N 3.37Å; E28-L31 PolarHBondContact O-N 3.17Å; L31-K33 PolarHBondContact O-N 3.19Å; L31-R34 WeakPolarHBondContact O-CB 3.48Å; L31-R34 PolarHBondContact O-N 2.97Å; L31-R34 VanDerWaalsContact O-N 3.17Å; L31-F35 HydrophobicContact CB-CD2 4.29Å; L31-F35 HydrophobicContact CB-CE2 4.18Å; L31-F35 HydrophobicContact CD2-CE2 3.96Å; L31-F35 HydrophobicContact CD2-CZ 4.48Å; L31-F35 VanDerWaalsContact O-CD2 3.23Å; L31-F35 WeakPolarHBondContact O-CD2 3.5Å; L31-F35 PolarHBondContact O-N 2.96Å; L31-D156 HydrophobicContact CD1-CB 4.07Å; L31-D156 HydrophobicContact CD2-CB 4Å; L31-L160 HydrophobicContact CB-CD2 3.77Å
32	I	96.4	Very high	90.9	Very high	55 Å²	55	79.7 Å²	79.7	28%	0.282	42%	0.417	S	S	.	.	H	α-helix	trans	-58.8	-49.3	173.8	-69.7	168.5	0	0	0	110.2	E28 R34 F35 K36 F91 L160	E28-I32 HydrophobicContact CG-CD1 3.88Å; E28-I32 HydrophobicContact CG-CG1 4.47Å; E28-I32 VanDerWaalsContact O-CG1 3.3Å; E28-I32 WeakPolarHBondContact O-CG1 3.34Å; E28-I32 PolarHBondContact O-N 2.9Å; I32-R34 VanDerWaalsContact C-N 3.26Å; I32-R34 PolarHBondContact O-N 3.5Å; I32-F35 PolarHBondContact O-N 3.09Å; I32-K36 WeakPolarHBondContact O-CB 3.24Å; I32-K36 PolarHBondContact O-N 3.14Å; I32-F91 HydrophobicContact CG1-CZ 4.42Å; I32-L160 HydrophobicContact CG1-CD1 4.24Å; I32-L160 HydrophobicContact CG1-CD2 3.94Å
33	K	96.9	Very high	93.2	Very high	170 Å²	170	75.3 Å²	75.3	74%	0.739	40%	0.398	S	S	*	.	H	α-helix	trans	-61.4	-37.3	177.2	-72.6	174.3	-177	177.2	0	111.8	A29 T30 L31	A29-K33 WeakPolarHBondContact O-CG 3.38Å; A29-K33 PolarHBondContact O-N 3.48Å; T30-K33 PolarHBondContact O-N 3.37Å; L31-K33 PolarHBondContact O-N 3.19Å
34	R	97.2	Very high	94.9	Very high	60 Å²	60	72.5 Å²	72.5	23%	0.226	37%	0.369	C	S	.	.	H	α-helix	trans	-68.1	-40	-179.1	-179.2	173.6	-174.2	68.6	0.8	113.4	Q24 T30 L31 I32 G39 V40 Y42 D153	Q24-R34 VanDerWaalsContact NE2-NH1 3.17Å; T30-R34 VanDerWaalsContact O-CB 3.24Å; T30-R34 WeakPolarHBondContact O-CB 3.48Å; T30-R34 PolarHBondContact O-N 2.86Å; L31-R34 WeakPolarHBondContact O-CB 3.48Å; L31-R34 PolarHBondContact O-N 2.97Å; L31-R34 VanDerWaalsContact O-N 3.17Å; I32-R34 VanDerWaalsContact C-N 3.26Å; I32-R34 PolarHBondContact O-N 3.5Å; R34-G39 CarbonylContact O-C 3.42Å; R34-G39 VanDerWaalsContact O-CA 3.32Å; R34-G39 WeakPolarHBondContact O-CA 3.45Å; R34-V40 HydrophobicContact CG-CG2 3.36Å; R34-Y42 PolarHBondContact NH2-OH 2.89Å; R34-D153 IonicContact CZ-OD1 2.67Å; R34-D153 IonicContact CZ-OD2 2.66Å; R34-D153 IonicContact NE-OD1 2.54Å; R34-D153 PolarHBondContact NE-OD1 2.83Å; R34-D153 IonicContact NE-OD2 2.83Å; R34-D153 IonicContact NH2-OD1 3.95Å; R34-D153 PolarHBondContact NH2-OD1 2.84Å; R34-D153 VanDerWaalsContact NH2-OD1 3.13Å; R34-D153 IonicContact NH2-OD2 3.41Å; R34-D153 PolarHBondContact NH2-OD2 2.89Å
35	F	97.8	Very high	95.9	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-101.6	-5	-174.5	-59.1	-51.9	0	0	0	114.7	L31 I32 V40 I89 S90 F91 D153 D156 L157 L160	L31-F35 HydrophobicContact CB-CD2 4.29Å; L31-F35 HydrophobicContact CB-CE2 4.18Å; L31-F35 HydrophobicContact CD2-CE2 3.96Å; L31-F35 HydrophobicContact CD2-CZ 4.48Å; L31-F35 VanDerWaalsContact O-CD2 3.23Å; L31-F35 WeakPolarHBondContact O-CD2 3.5Å; L31-F35 PolarHBondContact O-N 2.96Å; I32-F35 PolarHBondContact O-N 3.09Å; F35-V40 HydrophobicContact CD1-CG2 4.26Å; F35-V40 HydrophobicContact CE1-CG2 4.18Å; F35-I89 HydrophobicContact CD1-CG2 4.15Å; F35-I89 HydrophobicContact CE1-CG2 3.98Å; F35-S90 WeakPolarHBondContact O-CA 3.24Å; F35-S90 WeakPolarHBondContact O-CB 3.46Å; F35-F91 HydrophobicContact CB-CD2 4.19Å; F35-F91 HydrophobicContact CB-CE2 4.03Å; F35-F91 HydrophobicContact CB-CZ 4.32Å; F35-F91 VanDerWaalsContact O-CD2 3.28Å; F35-F91 WeakPolarHBondContact O-CD2 3.16Å; F35-F91 PolarHBondContact O-N 3.29Å; F35-F91 VanDerWaalsContact O-N 3.11Å; F35-D153 HydrophobicContact CE1-CB 4.03Å; F35-D153 HydrophobicContact CZ-CB 4.11Å; F35-D153 VanDerWaalsContact CZ-O 3.25Å; F35-D153 WeakPolarHBondContact CZ-O 3.44Å; F35-D156 HydrophobicContact CE2-CB 4.26Å; F35-D156 HydrophobicContact CZ-CB 4.37Å; F35-L157 HydrophobicContact CB-CD1 3.94Å; F35-L157 HydrophobicContact CD1-CD1 4.43Å; F35-L157 HydrophobicContact CD2-CB 4.18Å; F35-L157 HydrophobicContact CD2-CD1 3.9Å; F35-L157 HydrophobicContact CE1-CB 4.42Å; F35-L157 HydrophobicContact CE2-CB 3.95Å; F35-L157 HydrophobicContact CG-CD1 3.85Å; F35-L157 HydrophobicContact CZ-CB 4.09Å; F35-L160 HydrophobicContact CD2-CD2 4.31Å
36	K	95.9	Very high	96.5	Very high	154 Å²	154	68.3 Å²	68.3	67%	0.67	35%	0.346	S	S	*	.	S	Bend	trans	-68.2	147.9	173.7	-174.1	174.7	-178.7	-179	0	111.4	I32 E38 G39 F91	I32-K36 WeakPolarHBondContact O-CB 3.24Å; I32-K36 PolarHBondContact O-N 3.14Å; K36-E38 PolarHBondContact O-N 2.88Å; K36-G39 PolarHBondContact O-N 3.26Å; K36-F91 HydrophobicContact CB-CE2 4.35Å
37	G	96.1	Very high	96.8	Very high	64 Å²	64	65 Å²	65	66%	0.66	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	-127.7	178.7	0	0	0	0	0	111.9	G39	G37-G39 PolarHBondContact O-N 3.12Å
38	E	94.6	Very high	97	Very high	157 Å²	157	63.4 Å²	63.4	73%	0.734	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-14.7	176.9	-61.2	-169.2	168.3	0	0	113.4	K36	K36-E38 PolarHBondContact O-N 2.88Å
39	G	97.1	Very high	97.2	Very high	28 Å²	28	62.9 Å²	62.9	29%	0.289	32%	0.324	S	S	.	.			trans	65.9	-136.7	-179.8	0	0	0	0	0	113.1	R34 K36 G37 I89	R34-G39 CarbonylContact O-C 3.42Å; R34-G39 VanDerWaalsContact O-CA 3.32Å; R34-G39 WeakPolarHBondContact O-CA 3.45Å; K36-G39 PolarHBondContact O-N 3.26Å; G37-G39 PolarHBondContact O-N 3.12Å; G39-I89 CarbonylContact C-O 3.59Å; G39-I89 WeakPolarHBondContact CA-O 3.39Å
40	V	97.8	Very high	97.4	Very high	22 Å²	22	61.1 Å²	61.1	13%	0.133	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.4	-175.1	-170.3	0	0	0	0	110.6	R34 F35 Y42 T88 I89	R34-V40 HydrophobicContact CG-CG2 3.36Å; F35-V40 HydrophobicContact CD1-CG2 4.26Å; F35-V40 HydrophobicContact CE1-CG2 4.18Å; V40-Y42 HydrophobicContact CB-CE2 4.17Å; V40-Y42 HydrophobicContact CG1-CD2 4.29Å; V40-Y42 HydrophobicContact CG1-CE2 3.54Å; V40-T88 CarbonylContact O-C 3.51Å; V40-T88 WeakPolarHBondContact O-CA 3.23Å; V40-I89 PolarHBondContact N-O 3.5Å; V40-I89 PolarHBondContact O-N 3.36Å
41	R	97.6	Very high	97.5	Very high	130 Å²	130	66.1 Å²	66.1	49%	0.491	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.5	-179.5	-178.1	178	-93	179.8	-3.9	112.6	F86 L87 T88	R41-F86 HydrophobicContact CG-CB 4.02Å; R41-F86 HydrophobicContact CG-CD1 3.81Å; R41-F86 HydrophobicContact CG-CG 4.22Å; R41-L87 CarbonylContact C-O 3.48Å; R41-L87 WeakPolarHBondContact CA-O 3.3Å; R41-T88 HydrophobicContact CB-CG2 4.08Å; R41-T88 HydrophobicContact CG-CG2 4.13Å
42	Y	98.3	Very high	97.5	Very high	44 Å²	44	66.4 Å²	66.4	17%	0.173	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.4	178.1	-69.7	-79.5	0	0	0	111.9	R34 V40 F86 L87 I89 V150 D153	R34-Y42 PolarHBondContact NH2-OH 2.89Å; V40-Y42 HydrophobicContact CB-CE2 4.17Å; V40-Y42 HydrophobicContact CG1-CD2 4.29Å; V40-Y42 HydrophobicContact CG1-CE2 3.54Å; Y42-F86 WeakPolarHBondContact O-CA 3.41Å; Y42-L87 HydrophobicContact CD2-CD2 4.3Å; Y42-L87 PolarHBondContact N-O 2.8Å; Y42-L87 PolarHBondContact O-N 2.94Å; Y42-I89 HydrophobicContact CD2-CD1 4.31Å; Y42-I89 HydrophobicContact CE2-CD1 4.13Å; Y42-V150 HydrophobicContact CD1-CG2 3.62Å; Y42-V150 HydrophobicContact CD2-CG1 4.18Å; Y42-V150 HydrophobicContact CD2-CG2 3.94Å; Y42-V150 HydrophobicContact CE1-CG2 3.81Å; Y42-V150 HydrophobicContact CE2-CG1 4.41Å; Y42-V150 HydrophobicContact CE2-CG2 4.11Å; Y42-V150 HydrophobicContact CG-CG2 3.67Å; Y42-D153 WeakPolarHBondContact CE2-OD2 3.4Å; Y42-D153 PolarHBondContact OH-OD2 3.43Å
43	K	98.1	Very high	97.5	Very high	118 Å²	118	69.3 Å²	69.3	51%	0.513	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	127.7	168.1	-77.2	-167.7	176.9	-146.2	0	110.3	F86 E99 A144	K43-F86 HydrophobicContact CD-CE1 4.13Å; K43-F86 HydrophobicContact CG-CD1 3.88Å; K43-F86 HydrophobicContact CG-CE1 3.43Å; K43-F86 VanDerWaalsContact CG-CE1 3.43Å; K43-F86 HydrophobicContact CG-CZ 4.4Å; K43-E99 WeakPolarHBondContact CE-OE1 3.4Å; K43-E99 IonicContact NZ-OE1 2.7Å; K43-E99 PolarHBondContact NZ-OE1 3.31Å; K43-A144 HydrophobicContact CB-CB 3.96Å; K43-A144 WeakPolarHBondContact O-CB 3.13Å; K43-A144 PolarHBondContact O-N 2.86Å
44	A	98.5	Very high	97.5	Very high	6 Å²	6	63 Å²	63	5%	0.05	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	-179.2	-179.4	0	0	0	0	0	111.7	I85 I141 K142	A44-I85 HydrophobicContact CB-CD1 4.24Å; A44-I85 HydrophobicContact CB-CG1 4.01Å; A44-I85 PolarHBondContact N-O 3.41Å; A44-I85 WeakPolarHBondContact O-CG1 3.43Å; A44-I85 PolarHBondContact O-N 2.66Å; A44-I141 HydrophobicContact CB-CG2 3.61Å; A44-K142 CarbonylContact C-O 3.56Å; A44-K142 VanDerWaalsContact CA-O 3.27Å; A44-K142 WeakPolarHBondContact CA-O 3.36Å; A44-K142 WeakPolarHBondContact CB-O 3.35Å
45	K	98.5	Very high	97.5	Very high	85 Å²	85	61.7 Å²	61.7	37%	0.37	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.4	169.1	-62.4	-173.4	-178.9	-177.5	0	109	I47 K82 Q83 K84 K142	K45-I47 PolarHBondContact O-N 3.2Å; K45-K82 HydrophobicContact CB-CB 3.96Å; K45-K82 HydrophobicContact CB-CD 4.42Å; K45-K82 HydrophobicContact CD-CB 4.11Å; K45-Q83 CarbonylContact C-O 3.47Å; K45-Q83 WeakPolarHBondContact CA-O 3.3Å; K45-Q83 WeakPolarHBondContact CB-O 3.49Å; K45-K84 HydrophobicContact CG-CG 4.45Å; K45-K142 HydrophobicContact CB-CB 4.49Å; K45-K142 PolarHBondContact N-O 3.47Å; K45-K142 PolarHBondContact O-N 3.09Å
46	L	98.4	Very high	97.4	Very high	21 Å²	21	70.9 Å²	70.9	11%	0.11	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	122.9	171.9	-175.2	59.7	0	0	0	108.4	I49 K82 Q83 I85 V139 I141	L46-I49 HydrophobicContact CD1-CG1 4.43Å; L46-K82 WeakPolarHBondContact O-CB 3.22Å; L46-K82 WeakPolarHBondContact O-CG 3.37Å; L46-Q83 PolarHBondContact N-O 2.93Å; L46-I85 HydrophobicContact CB-CD1 4.24Å; L46-I85 HydrophobicContact CB-CG2 4.37Å; L46-V139 HydrophobicContact CD1-CG1 4.1Å; L46-I141 HydrophobicContact CD1-CD1 3.85Å
47	I	98.3	Very high	97.4	Very high	16 Å²	16	64.7 Å²	64.7	8%	0.082	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-48.2	170.3	-56.7	174.9	0	0	0	107.9	K45 M65 L68 K69 V72 K82 A125 A140 K142	K45-I47 PolarHBondContact O-N 3.2Å; I47-M65 HydrophobicContact CD1-CE 4.42Å; I47-M65 HydrophobicContact CD1-SD 3.71Å; I47-L68 HydrophobicContact CG2-CB 4Å; I47-K69 HydrophobicContact CG2-CG 4.25Å; I47-V72 HydrophobicContact CG2-CG2 3.94Å; I47-V72 WeakPolarHBondContact O-CG2 3.36Å; I47-K82 HydrophobicContact CG1-CD 4.17Å; I47-A125 HydrophobicContact CD1-CB 4.33Å; I47-A140 HydrophobicContact CB-CB 3.81Å; I47-A140 WeakPolarHBondContact CB-O 3.36Å; I47-A140 HydrophobicContact CD1-CB 4.21Å; I47-A140 HydrophobicContact CG1-CB 4.46Å; I47-A140 HydrophobicContact CG2-CB 4.27Å; I47-A140 PolarHBondContact N-O 3.48Å; I47-K142 HydrophobicContact CD1-CB 4.01Å; I47-K142 HydrophobicContact CG1-CB 3.87Å
48	G	98.1	Very high	97.4	Very high	15 Å²	15	67 Å²	67	16%	0.155	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.2	-176.8	175.1	0	0	0	0	0	111.9	A140	G48-A140 PolarHBondContact N-O 2.89Å; G48-A140 PolarHBondContact O-N 3.32Å
49	I	98.3	Very high	97.6	Very high	55 Å²	55	67.1 Å²	67.1	28%	0.282	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.2	175.3	-56.3	177.6	0	0	0	106.7	L46 R137 F138 V139	L46-I49 HydrophobicContact CD1-CG1 4.43Å; I49-R137 HydrophobicContact CG2-CB 4Å; I49-R137 HydrophobicContact CG2-CG 4.34Å; I49-F138 WeakPolarHBondContact CA-O 3.41Å; I49-V139 HydrophobicContact CG1-CG1 4.27Å; I49-V139 HydrophobicContact CG1-CG2 4.22Å; I49-V139 HydrophobicContact CG2-CG2 4.33Å
50	D	98.4	Very high	97.6	Very high	22 Å²	22	67.5 Å²	67.5	12%	0.118	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.8	-179.3	-171.2	33.7	0	0	0	109.8	S64 K67 L68 R137 F138	D50-S64 WeakPolarHBondContact CB-OG 3.47Å; D50-S64 WeakPolarHBondContact OD2-CB 3.19Å; D50-S64 PolarHBondContact OD2-OG 2.8Å; D50-K67 IonicContact OD1-NZ 3.63Å; D50-K67 PolarHBondContact OD1-NZ 2.87Å; D50-K67 IonicContact OD2-NZ 3.21Å; D50-L68 HydrophobicContact CB-CD1 3.91Å; D50-L68 HydrophobicContact CB-CD2 4.03Å; D50-L68 HydrophobicContact CB-CG 4.01Å; D50-R137 CarbonylContact O-C 3.37Å; D50-R137 VanDerWaalsContact O-CA 3.23Å; D50-R137 WeakPolarHBondContact O-CA 3.49Å; D50-F138 PolarHBondContact N-O 2.98Å; D50-F138 PolarHBondContact O-N 2.62Å
51	E	97.8	Very high	97.6	Very high	152 Å²	152	66.5 Å²	66.5	71%	0.71	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.2	172.8	-68.2	179.2	179.7	0	0	109.5	R137	E51-R137 HydrophobicContact CG-CG 4.31Å
52	V	97.8	Very high	97.6	Very high	21 Å²	21	61.5 Å²	61.5	13%	0.127	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.4	-176.5	-63.8	0	0	0	0	111.4	L60 V129 H136 F138	V52-L60 HydrophobicContact CB-CD1 4.27Å; V52-L60 HydrophobicContact CB-CD2 3.81Å; V52-L60 HydrophobicContact CB-CG 4.22Å; V52-L60 HydrophobicContact CG1-CD2 3.97Å; V52-L60 HydrophobicContact CG1-CG 4.42Å; V52-L60 HydrophobicContact CG2-CD2 4.05Å; V52-V129 HydrophobicContact CG2-CG1 4.02Å; V52-H136 HydrophobicContact CG2-CB 3.68Å; V52-H136 PolarHBondContact N-O 3.27Å; V52-F138 HydrophobicContact CG1-CB 3.63Å; V52-F138 HydrophobicContact CG2-CB 4.41Å
53	S	95.9	Very high	97.6	Very high	116 Å²	116	63.5 Å²	63.5	81%	0.811	33%	0.331	S	S	*	.	S	Bend	trans	-80.7	-16.2	-171.7	54.7	0	0	0	0	114.8
54	A	96.7	Very high	97.6	Very high	38 Å²	38	58 Å²	58	31%	0.314	31%	0.308	S	S	.	.	S	Bend	trans	-143.3	156.6	-176.4	0	0	0	0	0	112.3	R56 L60	A54-R56 PolarHBondContact O-N 2.93Å; A54-L60 HydrophobicContact CB-CD1 3.92Å
55	A	96.7	Very high	97.6	Very high	32 Å²	32	57.9 Å²	57.9	26%	0.264	31%	0.306	S	S	.	.	S	Bend	trans	-68.6	-16.6	-179.1	0	0	0	0	0	114.2	S114 Y115 V129 H136	A55-S114 VanDerWaalsContact O-CB 3.27Å; A55-S114 WeakPolarHBondContact O-CB 3.39Å; A55-S114 PolarHBondContact O-OG 3.02Å; A55-Y115 WeakPolarHBondContact O-CB 3.49Å; A55-V129 WeakPolarHBondContact O-CG1 3.4Å; A55-H136 PolarHBondContact N-CD2 3.19Å
56	R	96.8	Very high	97.6	Very high	192 Å²	192	58.8 Å²	58.8	73%	0.725	31%	0.313	S	S	*	.			trans	-156.4	157.1	-174	61.2	-179.2	179.2	132.1	-0.6	112.5	A54 Y115	A54-R56 PolarHBondContact O-N 2.93Å; R56-Y115 HydrophobicContact CB-CD2 3.66Å; R56-Y115 HydrophobicContact CB-CE2 4.26Å; R56-Y115 HydrophobicContact CB-CG 3.81Å
57	G	96.7	Very high	97.6	Very high	25 Å²	25	63.5 Å²	63.5	26%	0.258	33%	0.333	S	S	.	.			trans	142.3	127.3	169.2	0	0	0	0	0	112.7	K59 L60 C61	G57-K59 PolarHBondContact O-N 3.19Å; G57-L60 PolarHBondContact O-N 2.77Å; G57-C61 PolarHBondContact O-N 3.24Å; G57-C61 PolarHBondContact O-SG 2.81Å
58	D	95.6	Very high	97.6	Very high	111 Å²	111	63.5 Å²	63.5	59%	0.594	33%	0.332	S	S	*	.	H	α-helix	trans	-58.7	-48.9	-178.7	-69	-53.5	0	0	0	112.2	L60 C61 Q62 Y115	D58-L60 PolarHBondContact O-N 2.9Å; D58-C61 PolarHBondContact O-N 3.37Å; D58-Q62 WeakPolarHBondContact O-CB 3.32Å; D58-Q62 PolarHBondContact O-N 2.95Å; D58-Y115 PolarHBondContact OD1-OH 3.25Å; D58-Y115 PolarHBondContact OD2-OH 2.96Å
59	K	97.3	Very high	97.6	Very high	161 Å²	161	65.2 Å²	65.2	70%	0.7	34%	0.336	S	S	*	.	H	α-helix	trans	-60.1	-46.7	178.9	-175.8	177.2	177.7	-179	0	111.6	G57 C61 Q62 D63	G57-K59 PolarHBondContact O-N 3.19Å; K59-C61 VanDerWaalsContact C-N 3.33Å; K59-C61 PolarHBondContact O-N 3.36Å; K59-Q62 PolarHBondContact O-N 2.79Å; K59-D63 WeakPolarHBondContact O-CB 3.35Å; K59-D63 PolarHBondContact O-N 2.89Å
60	L	97.8	Very high	97.5	Very high	35 Å²	35	64.8 Å²	64.8	18%	0.183	35%	0.345	C	S	.	.	H	α-helix	trans	-59.2	-44	178	172.4	148.7	0	0	0	111.8	V52 A54 G57 D58 S64 V129	V52-L60 HydrophobicContact CB-CD1 4.27Å; V52-L60 HydrophobicContact CB-CD2 3.81Å; V52-L60 HydrophobicContact CB-CG 4.22Å; V52-L60 HydrophobicContact CG1-CD2 3.97Å; V52-L60 HydrophobicContact CG1-CG 4.42Å; V52-L60 HydrophobicContact CG2-CD2 4.05Å; A54-L60 HydrophobicContact CB-CD1 3.92Å; G57-L60 PolarHBondContact O-N 2.77Å; D58-L60 PolarHBondContact O-N 2.9Å; L60-S64 WeakPolarHBondContact O-CB 3.32Å; L60-S64 PolarHBondContact O-N 2.97Å; L60-S64 VanDerWaalsContact O-N 3.08Å; L60-V129 HydrophobicContact CD2-CG2 4.48Å
61	C	98.2	Very high	97.5	Very high	2 Å²	2	68.3 Å²	68.3	1%	0.014	37%	0.367	C	S	.	.	H	α-helix	trans	-68	-39.5	177.4	-64.8	0	0	0	0	111.9	G57 D58 K59 M65 A117 F138	G57-C61 PolarHBondContact O-N 3.24Å; G57-C61 PolarHBondContact O-SG 2.81Å; D58-C61 PolarHBondContact O-N 3.37Å; K59-C61 VanDerWaalsContact C-N 3.33Å; K59-C61 PolarHBondContact O-N 3.36Å; C61-M65 VanDerWaalsContact O-CB 3.24Å; C61-M65 WeakPolarHBondContact O-CB 3.47Å; C61-M65 PolarHBondContact O-N 2.92Å; C61-A117 HydrophobicContact CB-CB 3.39Å; C61-F138 HydrophobicContact CB-CD2 4.15Å; C61-F138 HydrophobicContact CB-CE2 3.57Å; C61-F138 HydrophobicContact CB-CZ 4.03Å; C61-F138 WeakPolarHBondContact O-CZ 3.36Å
62	Q	98.1	Very high	97.4	Very high	24 Å²	24	62.2 Å²	62.2	11%	0.112	34%	0.34	C	S	.	.	H	α-helix	trans	-68.4	-42.8	179.3	-167.6	63.5	27.9	0	0	111.7	D58 K59 M65 M66 D119 I120	D58-Q62 WeakPolarHBondContact O-CB 3.32Å; D58-Q62 PolarHBondContact O-N 2.95Å; K59-Q62 PolarHBondContact O-N 2.79Å; Q62-M65 PolarHBondContact O-N 3.26Å; Q62-M66 HydrophobicContact CG-CE 4.16Å; Q62-M66 WeakPolarHBondContact O-CB 3.38Å; Q62-M66 WeakPolarHBondContact O-CG 3.28Å; Q62-M66 PolarHBondContact O-N 3.35Å; Q62-D119 PolarHBondContact NE2-OD1 3.32Å; Q62-D119 VanDerWaalsContact NE2-OD1 3.1Å; Q62-I120 HydrophobicContact CG-CD1 4.41Å; Q62-I120 HydrophobicContact CG-CG1 4.5Å
63	D	98.1	Very high	97.3	Very high	86 Å²	86	64.1 Å²	64.1	46%	0.46	36%	0.358	S	S	.	.	H	α-helix	trans	-61.6	-45.8	176.6	-69.8	-16.6	0	0	0	110.4	K59 M66 K67	K59-D63 WeakPolarHBondContact O-CB 3.35Å; K59-D63 PolarHBondContact O-N 2.89Å; D63-M66 PolarHBondContact O-N 2.92Å; D63-K67 WeakPolarHBondContact O-CB 3.3Å; D63-K67 PolarHBondContact O-N 3.37Å
64	S	98.5	Very high	97.2	Very high	4 Å²	4	60.2 Å²	60.2	3%	0.028	34%	0.336	C	S	.	.	H	α-helix	trans	-63.9	-42.8	175.9	-173.9	0	0	0	0	112.5	D50 L60 M66 K67 L68 F138	D50-S64 WeakPolarHBondContact CB-OG 3.47Å; D50-S64 WeakPolarHBondContact OD2-CB 3.19Å; D50-S64 PolarHBondContact OD2-OG 2.8Å; L60-S64 WeakPolarHBondContact O-CB 3.32Å; L60-S64 PolarHBondContact O-N 2.97Å; L60-S64 VanDerWaalsContact O-N 3.08Å; S64-M66 PolarHBondContact O-N 2.86Å; S64-K67 PolarHBondContact O-N 3.03Å; S64-L68 WeakPolarHBondContact O-CB 3.49Å; S64-L68 WeakPolarHBondContact O-CG 3.23Å; S64-L68 PolarHBondContact O-N 3.11Å; S64-F138 VanDerWaalsContact OG-CD1 3.22Å; S64-F138 WeakPolarHBondContact OG-CD1 3.07Å
65	M	98.4	Very high	97.1	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.015	33%	0.33	C	S	.	.	H	α-helix	trans	-59.3	-45.3	173.9	179.9	63.1	73.3	0	0	111.9	I47 C61 Q62 L68 K69 D119 A125 F126 F138 A140	I47-M65 HydrophobicContact CD1-CE 4.42Å; I47-M65 HydrophobicContact CD1-SD 3.71Å; C61-M65 VanDerWaalsContact O-CB 3.24Å; C61-M65 WeakPolarHBondContact O-CB 3.47Å; C61-M65 PolarHBondContact O-N 2.92Å; Q62-M65 PolarHBondContact O-N 3.26Å; M65-L68 PolarHBondContact O-N 3.14Å; M65-K69 HydrophobicContact CG-CD 4.22Å; M65-K69 WeakPolarHBondContact O-CB 3.39Å; M65-K69 WeakPolarHBondContact O-CG 3.26Å; M65-K69 PolarHBondContact O-N 3.42Å; M65-K69 HydrophobicContact SD-CD 4.33Å; M65-K69 HydrophobicContact SD-CG 4.35Å; M65-D119 HydrophobicContact CE-CB 4.5Å; M65-D119 HydrophobicContact CG-CB 4.46Å; M65-D119 VanDerWaalsContact CG-OD2 3.29Å; M65-D119 WeakPolarHBondContact CG-OD2 3.33Å; M65-A125 HydrophobicContact CE-CB 4.47Å; M65-F126 WeakPolarHBondContact CE-O 3.36Å; M65-F138 HydrophobicContact CB-CE1 3.92Å; M65-F138 HydrophobicContact CB-CZ 4.27Å; M65-F138 HydrophobicContact CE-CE1 3.97Å; M65-F138 HydrophobicContact CE-CZ 3.91Å; M65-A140 HydrophobicContact CE-CB 3.69Å; M65-A140 HydrophobicContact SD-CB 3.8Å
66	M	98.2	Very high	96.9	Very high	103 Å²	103	66 Å²	66	51%	0.507	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-45.8	177.3	-75	-170.5	-178.2	0	0	111.6	Q62 D63 S64 L68 K69 G70 T121	Q62-M66 HydrophobicContact CG-CE 4.16Å; Q62-M66 WeakPolarHBondContact O-CB 3.38Å; Q62-M66 WeakPolarHBondContact O-CG 3.28Å; Q62-M66 PolarHBondContact O-N 3.35Å; D63-M66 PolarHBondContact O-N 2.92Å; S64-M66 PolarHBondContact O-N 2.86Å; M66-L68 PolarHBondContact O-N 2.87Å; M66-K69 PolarHBondContact O-N 2.99Å; M66-G70 PolarHBondContact O-N 3.3Å; M66-T121 HydrophobicContact CE-CG2 4.3Å
67	K	98.3	Very high	96.6	Very high	121 Å²	121	61.6 Å²	61.6	53%	0.526	35%	0.347	S	S	.	.	H	α-helix	trans	-55	-53.1	174.9	178.2	-173.2	174.9	-168.9	0	111.3	D50 D63 S64 K69 G70 V71	D50-K67 IonicContact OD1-NZ 3.63Å; D50-K67 PolarHBondContact OD1-NZ 2.87Å; D50-K67 IonicContact OD2-NZ 3.21Å; D63-K67 WeakPolarHBondContact O-CB 3.3Å; D63-K67 PolarHBondContact O-N 3.37Å; S64-K67 PolarHBondContact O-N 3.03Å; K67-K69 PolarHBondContact O-N 3.44Å; K67-G70 PolarHBondContact O-N 3.28Å; K67-G70 VanDerWaalsContact O-N 3.13Å; K67-V71 WeakPolarHBondContact O-CG2 3.42Å; K67-V71 PolarHBondContact O-N 3.4Å
68	L	98.3	Very high	96.4	Very high	15 Å²	15	68.6 Å²	68.6	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-62.4	-40.2	-179.9	-71.4	175.7	0	0	0	112.4	I47 D50 S64 M65 M66 G70 V71 V72 F138 A140	I47-L68 HydrophobicContact CG2-CB 4Å; D50-L68 HydrophobicContact CB-CD1 3.91Å; D50-L68 HydrophobicContact CB-CD2 4.03Å; D50-L68 HydrophobicContact CB-CG 4.01Å; S64-L68 WeakPolarHBondContact O-CB 3.49Å; S64-L68 WeakPolarHBondContact O-CG 3.23Å; S64-L68 PolarHBondContact O-N 3.11Å; M65-L68 PolarHBondContact O-N 3.14Å; M66-L68 PolarHBondContact O-N 2.87Å; L68-G70 VanDerWaalsContact C-N 3.33Å; L68-G70 PolarHBondContact O-N 3.01Å; L68-V71 PolarHBondContact O-N 2.61Å; L68-V72 WeakPolarHBondContact O-CB 3.41Å; L68-V72 VanDerWaalsContact O-CG2 3.32Å; L68-V72 WeakPolarHBondContact O-CG2 3.44Å; L68-V72 PolarHBondContact O-N 3.05Å; L68-F138 HydrophobicContact CD1-CD1 4.19Å; L68-A140 HydrophobicContact CD1-CB 3.56Å
69	K	97.5	Very high	96.2	Very high	51 Å²	51	65.7 Å²	65.7	22%	0.222	37%	0.366	C	S	.	.	H	α-helix	trans	-63.1	-38.2	173.8	-80.1	177.4	166	-175.5	0	112.4	I47 M65 M66 K67 V72 A73 D119 T121	I47-K69 HydrophobicContact CG2-CG 4.25Å; M65-K69 HydrophobicContact CG-CD 4.22Å; M65-K69 WeakPolarHBondContact O-CB 3.39Å; M65-K69 WeakPolarHBondContact O-CG 3.26Å; M65-K69 PolarHBondContact O-N 3.42Å; M65-K69 HydrophobicContact SD-CD 4.33Å; M65-K69 HydrophobicContact SD-CG 4.35Å; M66-K69 PolarHBondContact O-N 2.99Å; K67-K69 PolarHBondContact O-N 3.44Å; K69-V72 PolarHBondContact O-N 3.48Å; K69-A73 WeakPolarHBondContact O-CB 3.42Å; K69-A73 PolarHBondContact O-N 3.26Å; K69-D119 WeakPolarHBondContact CE-OD2 3.45Å; K69-D119 IonicContact NZ-OD1 3.13Å; K69-D119 IonicContact NZ-OD2 2.81Å; K69-D119 PolarHBondContact NZ-OD2 3.41Å; K69-T121 PolarHBondContact NZ-OG1 3.02Å; K69-T121 VanDerWaalsContact NZ-OG1 3.12Å
70	G	97	Very high	96	Very high	46 Å²	46	64 Å²	64	47%	0.474	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-47.2	174.7	0	0	0	0	0	112.2	M66 K67 L68 V72 A73 G74	M66-G70 PolarHBondContact O-N 3.3Å; K67-G70 PolarHBondContact O-N 3.28Å; K67-G70 VanDerWaalsContact O-N 3.13Å; L68-G70 VanDerWaalsContact C-N 3.33Å; L68-G70 PolarHBondContact O-N 3.01Å; G70-V72 PolarHBondContact O-N 3.4Å; G70-A73 WeakPolarHBondContact O-CB 3.36Å; G70-A73 PolarHBondContact O-N 2.5Å; G70-G74 PolarHBondContact O-N 3.42Å
71	V	96.9	Very high	95.8	Very high	97 Å²	97	69.7 Å²	69.7	59%	0.588	39%	0.386	S	S	*	.	H	α-helix	trans	-58.2	-48.2	174.5	175.2	0	0	0	0	110.9	K67 L68 A73 G74 A75	K67-V71 WeakPolarHBondContact O-CG2 3.42Å; K67-V71 PolarHBondContact O-N 3.4Å; L68-V71 PolarHBondContact O-N 2.61Å; V71-A73 VanDerWaalsContact C-N 3.3Å; V71-A73 PolarHBondContact O-N 2.95Å; V71-G74 PolarHBondContact O-N 3.43Å; V71-A75 PolarHBondContact O-N 2.76Å
72	V	96.4	Very high	95.6	Very high	24 Å²	24	72.2 Å²	72.2	15%	0.145	40%	0.397	C	S	.	.	H	α-helix	trans	-63.7	-34.1	178.2	168.8	0	0	0	0	112.5	I47 L68 K69 G70 R76 K82	I47-V72 HydrophobicContact CG2-CG2 3.94Å; I47-V72 WeakPolarHBondContact O-CG2 3.36Å; L68-V72 WeakPolarHBondContact O-CB 3.41Å; L68-V72 VanDerWaalsContact O-CG2 3.32Å; L68-V72 WeakPolarHBondContact O-CG2 3.44Å; L68-V72 PolarHBondContact O-N 3.05Å; K69-V72 PolarHBondContact O-N 3.48Å; G70-V72 PolarHBondContact O-N 3.4Å; V72-R76 VanDerWaalsContact O-CB 3.25Å; V72-R76 WeakPolarHBondContact O-CB 3.38Å; V72-R76 PolarHBondContact O-N 2.81Å; V72-K82 HydrophobicContact CG1-CD 3.87Å; V72-K82 HydrophobicContact CG1-CG 3.62Å; V72-K82 HydrophobicContact CG2-CG 4.28Å
73	A	95.1	Very high	95.6	Very high	60 Å²	60	74 Å²	74	50%	0.496	41%	0.405	S	S	.	.	H	α-helix	trans	-66.6	-42.4	175.3	0	0	0	0	0	111.3	K69 G70 V71 R76 S77	K69-A73 WeakPolarHBondContact O-CB 3.42Å; K69-A73 PolarHBondContact O-N 3.26Å; G70-A73 WeakPolarHBondContact O-CB 3.36Å; G70-A73 PolarHBondContact O-N 2.5Å; V71-A73 VanDerWaalsContact C-N 3.3Å; V71-A73 PolarHBondContact O-N 2.95Å; A73-R76 WeakPolarHBondContact O-CB 3.5Å; A73-R76 PolarHBondContact O-N 2.92Å; A73-S77 PolarHBondContact O-N 3.47Å
74	G	94.4	Very high	95.6	Very high	35 Å²	35	75.1 Å²	75.1	36%	0.361	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-36.1	174	0	0	0	0	0	113.7	G70 V71 R76 S77	G70-G74 PolarHBondContact O-N 3.42Å; V71-G74 PolarHBondContact O-N 3.43Å; G74-R76 VanDerWaalsContact C-N 3.35Å; G74-S77 PolarHBondContact O-OG 3.42Å
75	A	94.1	Very high	95.6	Very high	21 Å²	21	75 Å²	75	17%	0.174	41%	0.405	C	S	.	.	H	α-helix	trans	-68	-37.7	173.1	0	0	0	0	0	111.3	V71 S77 K78 G79 E80	V71-A75 PolarHBondContact O-N 2.76Å; A75-S77 VanDerWaalsContact C-N 3.33Å; A75-S77 PolarHBondContact O-N 3.05Å; A75-K78 CarbonylContact O-C 3.54Å; A75-K78 WeakPolarHBondContact O-CA 3.25Å; A75-K78 WeakPolarHBondContact O-CB 3.23Å; A75-K78 PolarHBondContact O-N 3.13Å; A75-G79 PolarHBondContact O-N 3.32Å; A75-E80 HydrophobicContact CB-CB 4.01Å; A75-E80 WeakPolarHBondContact O-CB 3.41Å; A75-E80 PolarHBondContact O-N 3.45Å
76	R	92.9	Very high	95.5	Very high	169 Å²	169	76.6 Å²	76.6	64%	0.638	41%	0.412	S	S	*	.	H	α-helix	trans	-62.9	-36.2	178.1	-174.6	-179.6	-175.2	169.2	1.2	112.9	V72 A73 G74 K78 G79 E80	V72-R76 VanDerWaalsContact O-CB 3.25Å; V72-R76 WeakPolarHBondContact O-CB 3.38Å; V72-R76 PolarHBondContact O-N 2.81Å; A73-R76 WeakPolarHBondContact O-CB 3.5Å; A73-R76 PolarHBondContact O-N 2.92Å; G74-R76 VanDerWaalsContact C-N 3.35Å; R76-K78 PolarHBondContact O-N 2.94Å; R76-G79 PolarHBondContact O-N 2.95Å; R76-G79 VanDerWaalsContact O-N 3.07Å; R76-E80 WeakPolarHBondContact CA-O 3.33Å
77	S	90.4	Very high	95.5	Very high	101 Å²	101	71.7 Å²	71.7	71%	0.706	39%	0.388	S	S	*	.	H	α-helix	trans	-67.4	-18.1	175.1	61.3	0	0	0	0	112.8	A73 G74 A75	A73-S77 PolarHBondContact O-N 3.47Å; G74-S77 PolarHBondContact O-OG 3.42Å; A75-S77 VanDerWaalsContact C-N 3.33Å; A75-S77 PolarHBondContact O-N 3.05Å
78	K	92.4	Very high	95.5	Very high	171 Å²	171	66.3 Å²	66.3	74%	0.743	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	4.7	172.2	-58.3	178.7	-178.2	-179.1	0	113.7	A75 R76	A75-K78 CarbonylContact O-C 3.54Å; A75-K78 WeakPolarHBondContact O-CA 3.25Å; A75-K78 WeakPolarHBondContact O-CB 3.23Å; A75-K78 PolarHBondContact O-N 3.13Å; R76-K78 PolarHBondContact O-N 2.94Å
79	G	91.1	Very high	95.5	Very high	51 Å²	51	65.6 Å²	65.6	53%	0.526	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	1	-179.7	0	0	0	0	0	115.1	A75 R76	A75-G79 PolarHBondContact O-N 3.32Å; R76-G79 PolarHBondContact O-N 2.95Å; R76-G79 VanDerWaalsContact O-N 3.07Å
80	E	93.4	Very high	95.6	Very high	124 Å²	124	63.4 Å²	63.4	58%	0.579	35%	0.352	S	S	*	.			trans	-77.2	143.4	177.2	-68	176.7	-161.9	0	0	111.6	A75 R76	A75-E80 HydrophobicContact CB-CB 4.01Å; A75-E80 WeakPolarHBondContact O-CB 3.41Å; A75-E80 PolarHBondContact O-N 3.45Å; R76-E80 WeakPolarHBondContact CA-O 3.33Å
81	H	93.6	Very high	95.6	Very high	156 Å²	156	64.6 Å²	64.6	72%	0.722	35%	0.345	S	S	*	.			trans	-122.6	139.4	-178.8	-65.9	-35.9	0	0	0	110.8	Q83	H81-Q83 PolarHBondContact O-N 3.11Å
82	K	94.9	Very high	95.6	Very high	54 Å²	54	61.5 Å²	61.5	24%	0.235	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-48.9	133.2	172.4	-74.9	177.7	-79.8	-68.8	0	110.7	K45 L46 I47 V72 K84	K45-K82 HydrophobicContact CB-CB 3.96Å; K45-K82 HydrophobicContact CB-CD 4.42Å; K45-K82 HydrophobicContact CD-CB 4.11Å; L46-K82 WeakPolarHBondContact O-CB 3.22Å; L46-K82 WeakPolarHBondContact O-CG 3.37Å; I47-K82 HydrophobicContact CG1-CD 4.17Å; V72-K82 HydrophobicContact CG1-CD 3.87Å; V72-K82 HydrophobicContact CG1-CG 3.62Å; V72-K82 HydrophobicContact CG2-CG 4.28Å; K82-K84 PolarHBondContact O-N 2.9Å
83	Q	96.9	Very high	95.7	Very high	62 Å²	62	60.4 Å²	60.4	29%	0.29	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-60.5	134.2	177.1	-166.7	-166.8	-19.1	0	0	110.3	K45 L46 H81 I85 D98	K45-Q83 CarbonylContact C-O 3.47Å; K45-Q83 WeakPolarHBondContact CA-O 3.3Å; K45-Q83 WeakPolarHBondContact CB-O 3.49Å; L46-Q83 PolarHBondContact N-O 2.93Å; H81-Q83 PolarHBondContact O-N 3.11Å; Q83-I85 HydrophobicContact CG-CG2 4.33Å; Q83-D98 PolarHBondContact NE2-OD2 3.13Å
84	K	98.1	Very high	95.8	Very high	110 Å²	110	57.5 Å²	57.5	48%	0.478	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	131.5	174.8	-67.6	178.7	177.9	-176.4	0	109.6	K45 K82 E99	K45-K84 HydrophobicContact CG-CG 4.45Å; K82-K84 PolarHBondContact O-N 2.9Å; K84-E99 HydrophobicContact CB-CB 3.86Å; K84-E99 VanDerWaalsContact CB-OE2 3.23Å; K84-E99 WeakPolarHBondContact CB-OE2 3.44Å; K84-E99 WeakPolarHBondContact CD-OE2 3.25Å; K84-E99 WeakPolarHBondContact O-CB 3.46Å; K84-E99 PolarHBondContact O-N 2.85Å
85	I	98.6	Very high	96	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	158.2	-173.4	60.1	165.1	0	0	0	111.9	A44 L46 Q83 I96 F97 I141	A44-I85 HydrophobicContact CB-CD1 4.24Å; A44-I85 HydrophobicContact CB-CG1 4.01Å; A44-I85 PolarHBondContact N-O 3.41Å; A44-I85 WeakPolarHBondContact O-CG1 3.43Å; A44-I85 PolarHBondContact O-N 2.66Å; L46-I85 HydrophobicContact CB-CD1 4.24Å; L46-I85 HydrophobicContact CB-CG2 4.37Å; Q83-I85 HydrophobicContact CG-CG2 4.33Å; I85-I96 HydrophobicContact CB-CG2 3.95Å; I85-I96 HydrophobicContact CD1-CG2 3.68Å; I85-I96 HydrophobicContact CG1-CG2 4.41Å; I85-I96 HydrophobicContact CG2-CG2 3.83Å; I85-F97 CarbonylContact C-O 3.52Å; I85-F97 WeakPolarHBondContact CA-O 3.39Å; I85-F97 VanDerWaalsContact CB-O 3.22Å; I85-F97 WeakPolarHBondContact CB-O 3.38Å; I85-I141 HydrophobicContact CD1-CD1 3.86Å
86	F	97.8	Very high	96.2	Very high	37 Å²	37	57.7 Å²	57.7	16%	0.162	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.7	157.6	-68	-70.7	0	0	0	109.7	R41 Y42 K43 F97 E99	R41-F86 HydrophobicContact CG-CB 4.02Å; R41-F86 HydrophobicContact CG-CD1 3.81Å; R41-F86 HydrophobicContact CG-CG 4.22Å; Y42-F86 WeakPolarHBondContact O-CA 3.41Å; K43-F86 HydrophobicContact CD-CE1 4.13Å; K43-F86 HydrophobicContact CG-CD1 3.88Å; K43-F86 HydrophobicContact CG-CE1 3.43Å; K43-F86 VanDerWaalsContact CG-CE1 3.43Å; K43-F86 HydrophobicContact CG-CZ 4.4Å; F86-F97 HydrophobicContact CB-CB 4.35Å; F86-F97 PolarHBondContact N-O 2.89Å; F86-F97 PolarHBondContact O-N 2.9Å; F86-E99 HydrophobicContact CD2-CB 4.19Å; F86-E99 HydrophobicContact CD2-CG 4.26Å; F86-E99 HydrophobicContact CE2-CB 4.02Å; F86-E99 HydrophobicContact CE2-CG 3.6Å; F86-E99 HydrophobicContact CZ-CG 3.87Å
87	L	97.9	Very high	96.5	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.7	171.7	178.9	143	0	0	0	108.7	R41 Y42 I89 I94 K95 F126 I141 V150	R41-L87 CarbonylContact C-O 3.48Å; R41-L87 WeakPolarHBondContact CA-O 3.3Å; Y42-L87 HydrophobicContact CD2-CD2 4.3Å; Y42-L87 PolarHBondContact N-O 2.8Å; Y42-L87 PolarHBondContact O-N 2.94Å; L87-I89 HydrophobicContact CD2-CD1 3.87Å; L87-I89 HydrophobicContact CD2-CG1 3.66Å; L87-I94 HydrophobicContact CD1-CG2 3.93Å; L87-I94 HydrophobicContact CG-CG2 4.09Å; L87-K95 WeakPolarHBondContact CA-O 3.45Å; L87-F126 HydrophobicContact CD1-CZ 4.03Å; L87-I141 HydrophobicContact CD1-CD1 4.47Å; L87-I141 HydrophobicContact CD1-CG1 4.22Å; L87-I141 HydrophobicContact CD1-CG2 4.41Å; L87-V150 HydrophobicContact CD2-CG1 3.93Å
88	T	98.4	Very high	96.9	Very high	8 Å²	8	47.4 Å²	47.4	5%	0.049	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	139	173.4	67.4	0	0	0	0	111.7	V40 R41 I94 K95 F97	V40-T88 CarbonylContact O-C 3.51Å; V40-T88 WeakPolarHBondContact O-CA 3.23Å; R41-T88 HydrophobicContact CB-CG2 4.08Å; R41-T88 HydrophobicContact CG-CG2 4.13Å; T88-I94 WeakPolarHBondContact O-CA 3.49Å; T88-K95 PolarHBondContact N-O 3.08Å; T88-K95 PolarHBondContact O-N 3.38Å; T88-K95 WeakPolarHBondContact OG1-CB 3.34Å; T88-F97 HydrophobicContact CG2-CD2 4.1Å; T88-F97 HydrophobicContact CG2-CE2 3.71Å
89	I	98.5	Very high	97	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.5	177.3	-62.1	168.2	0	0	0	108.3	F35 G39 V40 Y42 L87 V150 D153 L154 L157	F35-I89 HydrophobicContact CD1-CG2 4.15Å; F35-I89 HydrophobicContact CE1-CG2 3.98Å; G39-I89 CarbonylContact C-O 3.59Å; G39-I89 WeakPolarHBondContact CA-O 3.39Å; V40-I89 PolarHBondContact N-O 3.5Å; V40-I89 PolarHBondContact O-N 3.36Å; Y42-I89 HydrophobicContact CD2-CD1 4.31Å; Y42-I89 HydrophobicContact CE2-CD1 4.13Å; L87-I89 HydrophobicContact CD2-CD1 3.87Å; L87-I89 HydrophobicContact CD2-CG1 3.66Å; I89-V150 HydrophobicContact CD1-CG1 3.61Å; I89-D153 HydrophobicContact CD1-CB 4.08Å; I89-L154 HydrophobicContact CD1-CD1 4.45Å; I89-L154 HydrophobicContact CD1-CD2 3.83Å; I89-L154 HydrophobicContact CD1-CG 3.73Å; I89-L154 HydrophobicContact CG1-CD2 3.9Å; I89-L154 HydrophobicContact CG1-CG 4.37Å; I89-L154 HydrophobicContact CG2-CD2 3.98Å; I89-L157 HydrophobicContact CG2-CB 4.39Å; I89-L157 HydrophobicContact CG2-CD2 3.57Å
90	S	98.4	Very high	97.2	Very high	4 Å²	4	48.4 Å²	48.4	3%	0.028	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	178.1	-178.4	65.7	0	0	0	0	110.6	F35 G92 G93 L157	F35-S90 WeakPolarHBondContact O-CA 3.24Å; F35-S90 WeakPolarHBondContact O-CB 3.46Å; S90-G92 PolarHBondContact O-N 2.82Å; S90-G92 VanDerWaalsContact O-N 3.11Å; S90-G92 PolarHBondContact OG-N 2.94Å; S90-G92 VanDerWaalsContact OG-N 3.14Å; S90-G93 PolarHBondContact N-O 2.8Å; S90-G93 VanDerWaalsContact N-O 3.13Å; S90-G93 WeakPolarHBondContact O-CA 3.32Å; S90-G93 PolarHBondContact O-N 3.32Å; S90-L157 VanDerWaalsContact O-CD2 3.24Å; S90-L157 WeakPolarHBondContact O-CD2 3.29Å
91	F	97.6	Very high	97.4	Very high	72 Å²	72	47.5 Å²	47.5	32%	0.316	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.3	168	-70.8	-67.8	0	0	0	113.6	I32 F35 K36 G93 L157 L160 I161 L164	I32-F91 HydrophobicContact CG1-CZ 4.42Å; F35-F91 HydrophobicContact CB-CD2 4.19Å; F35-F91 HydrophobicContact CB-CE2 4.03Å; F35-F91 HydrophobicContact CB-CZ 4.32Å; F35-F91 VanDerWaalsContact O-CD2 3.28Å; F35-F91 WeakPolarHBondContact O-CD2 3.16Å; F35-F91 PolarHBondContact O-N 3.29Å; F35-F91 VanDerWaalsContact O-N 3.11Å; K36-F91 HydrophobicContact CB-CE2 4.35Å; F91-G93 PolarHBondContact O-N 3.33Å; F91-L157 HydrophobicContact CD1-CD1 4.14Å; F91-L157 HydrophobicContact CE1-CD1 4.43Å; F91-L160 HydrophobicContact CE1-CD2 3.91Å; F91-L160 HydrophobicContact CE1-CG 4.43Å; F91-L160 HydrophobicContact CZ-CD2 3.75Å; F91-I161 HydrophobicContact CD1-CD1 3.93Å; F91-I161 HydrophobicContact CD1-CG1 3.79Å; F91-I161 HydrophobicContact CE1-CG1 3.98Å; F91-L164 HydrophobicContact CE1-CD1 4.31Å
92	G	96.9	Very high	97.5	Very high	32 Å²	32	42.2 Å²	42.2	33%	0.33	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-4.5	172.2	0	0	0	0	0	114.3	S90 H107	S90-G92 PolarHBondContact O-N 2.82Å; S90-G92 VanDerWaalsContact O-N 3.11Å; S90-G92 PolarHBondContact OG-N 2.94Å; S90-G92 VanDerWaalsContact OG-N 3.14Å; G92-H107 PolarHBondContact O-NE2 3.41Å
93	G	97.8	Very high	97.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.3	-145.4	-176.6	0	0	0	0	0	112.8	S90 F91 H108	S90-G93 PolarHBondContact N-O 2.8Å; S90-G93 VanDerWaalsContact N-O 3.13Å; S90-G93 WeakPolarHBondContact O-CA 3.32Å; S90-G93 PolarHBondContact O-N 3.32Å; F91-G93 PolarHBondContact O-N 3.33Å; G93-H108 CarbonylContact C-O 3.46Å; G93-H108 WeakPolarHBondContact CA-O 3.34Å
94	I	98.6	Very high	97.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.3	-179.9	-61.1	174.7	0	0	0	109	L87 T88 H108 I113 Y128 L154	L87-I94 HydrophobicContact CD1-CG2 3.93Å; L87-I94 HydrophobicContact CG-CG2 4.09Å; T88-I94 WeakPolarHBondContact O-CA 3.49Å; I94-H108 PolarHBondContact N-O 3.46Å; I94-H108 PolarHBondContact O-N 3.45Å; I94-I113 HydrophobicContact CB-CD1 4.14Å; I94-I113 HydrophobicContact CD1-CD1 3.61Å; I94-I113 HydrophobicContact CG1-CD1 3.62Å; I94-Y128 HydrophobicContact CD1-CD1 3.74Å; I94-Y128 HydrophobicContact CD1-CD2 4.13Å; I94-Y128 HydrophobicContact CD1-CE1 3.74Å; I94-Y128 HydrophobicContact CD1-CE2 4.15Å; I94-Y128 HydrophobicContact CD1-CG 3.94Å; I94-Y128 HydrophobicContact CG2-CE1 4.07Å; I94-L154 HydrophobicContact CD1-CD1 4.19Å; I94-L154 HydrophobicContact CD1-CD2 3.64Å; I94-L154 HydrophobicContact CG1-CD2 3.75Å
95	K	98.5	Very high	97.6	Very high	60 Å²	60	41.7 Å²	41.7	26%	0.261	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.4	169.4	-63.6	176.2	-179.5	179.3	0	110.5	L87 T88 F97 L104 H106 H107	L87-K95 WeakPolarHBondContact CA-O 3.45Å; T88-K95 PolarHBondContact N-O 3.08Å; T88-K95 PolarHBondContact O-N 3.38Å; T88-K95 WeakPolarHBondContact OG1-CB 3.34Å; K95-F97 HydrophobicContact CB-CD2 4.27Å; K95-F97 HydrophobicContact CB-CE2 3.48Å; K95-F97 VanDerWaalsContact CB-CE2 3.48Å; K95-F97 HydrophobicContact CB-CZ 3.91Å; K95-F97 HydrophobicContact CD-CE2 4.31Å; K95-F97 HydrophobicContact CD-CZ 3.96Å; K95-L104 HydrophobicContact CB-CD1 3.69Å; K95-L104 HydrophobicContact CD-CD1 4.16Å; K95-L104 HydrophobicContact CG-CD1 4.02Å; K95-H106 CarbonylContact C-O 3.58Å; K95-H106 WeakPolarHBondContact CA-O 3.26Å; K95-H107 HydrophobicContact CG-CB 4.17Å; K95-H107 VanDerWaalsContact CG-CD2 3.49Å; K95-H107 WeakPolarHBondContact CG-CD2 3.23Å
96	I	98.5	Very high	97.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.1	177.3	-60.8	176.6	0	0	0	107.8	I85 Q105 H106 V139 I141	I85-I96 HydrophobicContact CB-CG2 3.95Å; I85-I96 HydrophobicContact CD1-CG2 3.68Å; I85-I96 HydrophobicContact CG1-CG2 4.41Å; I85-I96 HydrophobicContact CG2-CG2 3.83Å; I96-Q105 PolarHBondContact O-N 3.32Å; I96-H106 HydrophobicContact CB-CB 4.1Å; I96-H106 HydrophobicContact CD1-CB 4.26Å; I96-H106 HydrophobicContact CG1-CB 4.42Å; I96-H106 PolarHBondContact N-O 2.99Å; I96-H106 PolarHBondContact O-N 2.83Å; I96-V139 HydrophobicContact CD1-CG1 3.98Å; I96-I141 HydrophobicContact CD1-CD1 4.06Å
97	F	98.4	Very high	97.6	Very high	34 Å²	34	46.6 Å²	46.6	15%	0.149	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.9	177.5	-57.9	-96.8	0	0	0	110	I85 F86 T88 K95 A103 L104	I85-F97 CarbonylContact C-O 3.52Å; I85-F97 WeakPolarHBondContact CA-O 3.39Å; I85-F97 VanDerWaalsContact CB-O 3.22Å; I85-F97 WeakPolarHBondContact CB-O 3.38Å; F86-F97 HydrophobicContact CB-CB 4.35Å; F86-F97 PolarHBondContact N-O 2.89Å; F86-F97 PolarHBondContact O-N 2.9Å; T88-F97 HydrophobicContact CG2-CD2 4.1Å; T88-F97 HydrophobicContact CG2-CE2 3.71Å; K95-F97 HydrophobicContact CB-CD2 4.27Å; K95-F97 HydrophobicContact CB-CE2 3.48Å; K95-F97 VanDerWaalsContact CB-CE2 3.48Å; K95-F97 HydrophobicContact CB-CZ 3.91Å; K95-F97 HydrophobicContact CD-CE2 4.31Å; K95-F97 HydrophobicContact CD-CZ 3.96Å; F97-A103 VanDerWaalsContact CA-O 3.26Å; F97-A103 WeakPolarHBondContact CA-O 3.47Å; F97-L104 HydrophobicContact CD1-CB 3.95Å; F97-L104 HydrophobicContact CD1-CD1 4.1Å; F97-L104 HydrophobicContact CE1-CB 3.8Å; F97-L104 HydrophobicContact CE1-CD1 3.73Å; F97-L104 HydrophobicContact CE1-CG 4.31Å; F97-L104 HydrophobicContact CE2-CD1 4.25Å; F97-L104 HydrophobicContact CZ-CD1 3.82Å
98	D	97.9	Very high	97.6	Very high	20 Å²	20	47.1 Å²	47.1	11%	0.107	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	130.3	169.7	178.5	-104.3	0	0	0	110.8	Q83 K100 T101 G102 A103 Q105	Q83-D98 PolarHBondContact NE2-OD2 3.13Å; D98-K100 VanDerWaalsContact C-N 3.27Å; D98-K100 PolarHBondContact O-N 2.78Å; D98-K100 WeakPolarHBondContact OD1-CB 3.25Å; D98-K100 PolarHBondContact OD1-N 3.05Å; D98-K100 VanDerWaalsContact OD1-N 3.13Å; D98-T101 WeakPolarHBondContact CB-OG1 3.41Å; D98-T101 PolarHBondContact OD1-N 3.11Å; D98-T101 PolarHBondContact OD1-OG1 3.03Å; D98-G102 VanDerWaalsContact O-CA 3.3Å; D98-G102 WeakPolarHBondContact O-CA 3.36Å; D98-G102 PolarHBondContact O-N 3.3Å; D98-A103 PolarHBondContact N-O 3.32Å; D98-Q105 HydrophobicContact CB-CG 4.44Å
99	E	96.3	Very high	97.5	Very high	54 Å²	54	47.6 Å²	47.6	25%	0.252	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.7	-176.1	177.8	170.6	-150.8	0	0	112.3	K43 K84 F86	K43-E99 WeakPolarHBondContact CE-OE1 3.4Å; K43-E99 IonicContact NZ-OE1 2.7Å; K43-E99 PolarHBondContact NZ-OE1 3.31Å; K84-E99 HydrophobicContact CB-CB 3.86Å; K84-E99 VanDerWaalsContact CB-OE2 3.23Å; K84-E99 WeakPolarHBondContact CB-OE2 3.44Å; K84-E99 WeakPolarHBondContact CD-OE2 3.25Å; K84-E99 WeakPolarHBondContact O-CB 3.46Å; K84-E99 PolarHBondContact O-N 2.85Å; F86-E99 HydrophobicContact CD2-CB 4.19Å; F86-E99 HydrophobicContact CD2-CG 4.26Å; F86-E99 HydrophobicContact CE2-CB 4.02Å; F86-E99 HydrophobicContact CE2-CG 3.6Å; F86-E99 HydrophobicContact CZ-CG 3.87Å
100	K	95.1	Very high	97.4	Very high	188 Å²	188	48.9 Å²	48.9	82%	0.817	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-48.7	-176.1	-66.2	-177.8	177.3	-179.2	0	112.3	D98	D98-K100 VanDerWaalsContact C-N 3.27Å; D98-K100 PolarHBondContact O-N 2.78Å; D98-K100 WeakPolarHBondContact OD1-CB 3.25Å; D98-K100 PolarHBondContact OD1-N 3.05Å; D98-K100 VanDerWaalsContact OD1-N 3.13Å
101	T	96.4	Very high	97.3	Very high	105 Å²	105	55.9 Å²	55.9	64%	0.644	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-21.1	-173.4	59.4	0	0	0	0	112.8	D98 A103	D98-T101 WeakPolarHBondContact CB-OG1 3.41Å; D98-T101 PolarHBondContact OD1-N 3.11Å; D98-T101 PolarHBondContact OD1-OG1 3.03Å; T101-A103 PolarHBondContact O-N 3.43Å; T101-A103 WeakPolarHBondContact OG1-CB 3.45Å; T101-A103 PolarHBondContact OG1-N 3.03Å
102	G	95.2	Very high	97.2	Very high	46 Å²	46	55.2 Å²	55.2	47%	0.474	30%	0.298	S	S	.	.			trans	71.4	4.7	-171.7	0	0	0	0	0	113.9	D98	D98-G102 VanDerWaalsContact O-CA 3.3Å; D98-G102 WeakPolarHBondContact O-CA 3.36Å; D98-G102 PolarHBondContact O-N 3.3Å
103	A	97.5	Very high	97.3	Very high	49 Å²	49	54.5 Å²	54.5	41%	0.405	29%	0.286	S	S	.	.			trans	-69.4	136.7	-179.8	0	0	0	0	0	111.3	F97 D98 T101 Q105	F97-A103 VanDerWaalsContact CA-O 3.26Å; F97-A103 WeakPolarHBondContact CA-O 3.47Å; D98-A103 PolarHBondContact N-O 3.32Å; T101-A103 PolarHBondContact O-N 3.43Å; T101-A103 WeakPolarHBondContact OG1-CB 3.45Å; T101-A103 PolarHBondContact OG1-N 3.03Å; A103-Q105 PolarHBondContact O-N 2.98Å
104	L	97.9	Very high	97.2	Very high	87 Å²	87	56.9 Å²	56.9	46%	0.455	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	121.2	171.5	178.5	64.2	0	0	0	109.3	K95 F97 H106 H107	K95-L104 HydrophobicContact CB-CD1 3.69Å; K95-L104 HydrophobicContact CD-CD1 4.16Å; K95-L104 HydrophobicContact CG-CD1 4.02Å; F97-L104 HydrophobicContact CD1-CB 3.95Å; F97-L104 HydrophobicContact CD1-CD1 4.1Å; F97-L104 HydrophobicContact CE1-CB 3.8Å; F97-L104 HydrophobicContact CE1-CD1 3.73Å; F97-L104 HydrophobicContact CE1-CG 4.31Å; F97-L104 HydrophobicContact CE2-CD1 4.25Å; F97-L104 HydrophobicContact CZ-CD1 3.82Å; L104-H106 WeakPolarHBondContact CD1-O 3.23Å; L104-H107 HydrophobicContact CD1-CB 4.49Å; L104-H107 HydrophobicContact CD2-CB 4.38Å
105	Q	97.4	Very high	97.2	Very high	79 Å²	79	59.9 Å²	59.9	37%	0.369	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-40.6	-179.9	-68.4	-170.6	-32.8	0	0	113	I96 D98 A103	I96-Q105 PolarHBondContact O-N 3.32Å; D98-Q105 HydrophobicContact CB-CG 4.44Å; A103-Q105 PolarHBondContact O-N 2.98Å
106	H	97.8	Very high	97.2	Very high	50 Å²	50	58.8 Å²	58.8	23%	0.231	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.1	179	-52.3	-72.4	0	0	0	110.3	K95 I96 L104	K95-H106 CarbonylContact C-O 3.58Å; K95-H106 WeakPolarHBondContact CA-O 3.26Å; I96-H106 HydrophobicContact CB-CB 4.1Å; I96-H106 HydrophobicContact CD1-CB 4.26Å; I96-H106 HydrophobicContact CG1-CB 4.42Å; I96-H106 PolarHBondContact N-O 2.99Å; I96-H106 PolarHBondContact O-N 2.83Å; L104-H106 WeakPolarHBondContact CD1-O 3.23Å
107	H	97.8	Very high	97.2	Very high	90 Å²	90	59.1 Å²	59.1	42%	0.417	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	121	172.7	179.4	-160	0	0	0	107.9	G92 K95 L104	G92-H107 PolarHBondContact O-NE2 3.41Å; K95-H107 HydrophobicContact CG-CB 4.17Å; K95-H107 VanDerWaalsContact CG-CD2 3.49Å; K95-H107 WeakPolarHBondContact CG-CD2 3.23Å; L104-H107 HydrophobicContact CD1-CB 4.49Å; L104-H107 HydrophobicContact CD2-CB 4.38Å
108	H	97.8	Very high	97.1	Very high	11 Å²	11	62.7 Å²	62.7	5%	0.051	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.8	175.1	-48.7	108.2	0	0	0	107.9	G93 I94 E112 I113 Y128 C130	G93-H108 CarbonylContact C-O 3.46Å; G93-H108 WeakPolarHBondContact CA-O 3.34Å; I94-H108 PolarHBondContact N-O 3.46Å; I94-H108 PolarHBondContact O-N 3.45Å; H108-E112 WeakPolarHBondContact CA-OE2 3.43Å; H108-I113 HydrophobicContact CB-CD1 4.37Å; H108-I113 HydrophobicContact CB-CG1 4.12Å; H108-Y128 PolarHBondContact CE1-OH 2.92Å; H108-Y128 VanDerWaalsContact CE1-OH 3.24Å; H108-Y128 AromaticContact ND1-CE2 3.61Å; H108-Y128 AromaticContact ND1-CZ 3.69Å; H108-Y128 PolarHBondContact ND1-OH 2.82Å; H108-C130 HydrophobicContact CB-CB 4.33Å; H108-C130 VanDerWaalsContact CD2-SG 3.59Å
109	A	97.5	Very high	97.1	Very high	19 Å²	19	61.9 Å²	61.9	16%	0.157	33%	0.325	C	S	.	.			trans	-68.4	158	178.3	0	0	0	0	0	110.8	H111 E112 I113	A109-H111 WeakPolarHBondContact CB-CE1 3.22Å; A109-H111 PolarHBondContact O-N 2.87Å; A109-E112 HydrophobicContact CB-CG 4.18Å; A109-E112 PolarHBondContact N-OE2 3.47Å; A109-E112 WeakPolarHBondContact O-CB 3.11Å; A109-E112 PolarHBondContact O-N 3.41Å; A109-I113 PolarHBondContact O-N 3.4Å
110	V	96.9	Very high	97.1	Very high	27 Å²	27	66.2 Å²	66.2	16%	0.164	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-54.6	-41.3	-178	172.6	0	0	0	0	112.2	E112 I113 L157 F158 I161	V110-E112 PolarHBondContact O-N 2.97Å; V110-I113 PolarHBondContact O-N 2.99Å; V110-L157 HydrophobicContact CG2-CD2 4.18Å; V110-F158 HydrophobicContact CB-CE1 4.48Å; V110-F158 HydrophobicContact CG1-CD1 3.71Å; V110-F158 HydrophobicContact CG1-CE1 3.84Å; V110-F158 HydrophobicContact CG2-CE1 4.39Å; V110-I161 HydrophobicContact CB-CD1 4.1Å; V110-I161 HydrophobicContact CG1-CD1 3.75Å; V110-I161 HydrophobicContact CG1-CG2 4.48Å; V110-I161 HydrophobicContact CG2-CD1 3.62Å
111	H	94.8	Very high	97.1	Very high	151 Å²	151	61.4 Å²	61.4	70%	0.699	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-72	-11.4	-179.4	65.5	-91.9	0	0	0	113.9	A109	A109-H111 WeakPolarHBondContact CB-CE1 3.22Å; A109-H111 PolarHBondContact O-N 2.87Å
112	E	96.4	Very high	97.2	Very high	58 Å²	58	57.5 Å²	57.5	27%	0.271	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-94.1	-12.7	176.7	-57.9	178.8	129.5	0	0	112	H108 A109 V110 C130 G131	H108-E112 WeakPolarHBondContact CA-OE2 3.43Å; A109-E112 HydrophobicContact CB-CG 4.18Å; A109-E112 PolarHBondContact N-OE2 3.47Å; A109-E112 WeakPolarHBondContact O-CB 3.11Å; A109-E112 PolarHBondContact O-N 3.41Å; V110-E112 PolarHBondContact O-N 2.97Å; E112-C130 CarbonylContact O-C 3.57Å; E112-C130 WeakPolarHBondContact O-CA 3.32Å; E112-C130 WeakPolarHBondContact O-CB 3.43Å; E112-G131 PolarHBondContact O-N 3.36Å
113	I	97.8	Very high	97.3	Very high	16 Å²	16	61.3 Å²	61.3	8%	0.082	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	119.8	-178.8	-59.2	160	0	0	0	108.4	I94 H108 A109 V110 I116 Y128 C130 F158	I94-I113 HydrophobicContact CB-CD1 4.14Å; I94-I113 HydrophobicContact CD1-CD1 3.61Å; I94-I113 HydrophobicContact CG1-CD1 3.62Å; H108-I113 HydrophobicContact CB-CD1 4.37Å; H108-I113 HydrophobicContact CB-CG1 4.12Å; A109-I113 PolarHBondContact O-N 3.4Å; V110-I113 PolarHBondContact O-N 2.99Å; I113-I116 HydrophobicContact CG2-CD1 3.79Å; I113-Y128 HydrophobicContact CG1-CD2 4.42Å; I113-Y128 HydrophobicContact CG2-CD2 4.29Å; I113-C130 HydrophobicContact CG1-CB 4.32Å; I113-F158 HydrophobicContact CB-CZ 4.03Å; I113-F158 HydrophobicContact CD1-CE1 4.44Å; I113-F158 HydrophobicContact CD1-CZ 4.14Å; I113-F158 HydrophobicContact CG2-CE2 4.14Å; I113-F158 HydrophobicContact CG2-CZ 3.71Å
114	S	97.4	Very high	97.3	Very high	51 Å²	51	63.6 Å²	63.6	36%	0.357	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-28.5	-172.1	54	0	0	0	0	113.5	A55 V129	A55-S114 VanDerWaalsContact O-CB 3.27Å; A55-S114 WeakPolarHBondContact O-CB 3.39Å; A55-S114 PolarHBondContact O-OG 3.02Å; S114-V129 PolarHBondContact N-O 2.99Å; S114-V129 WeakPolarHBondContact OG-CB 3.43Å; S114-V129 WeakPolarHBondContact OG-CG1 3.35Å; S114-V129 PolarHBondContact OG-O 2.92Å
115	Y	98	Very high	97.4	Very high	62 Å²	62	59.5 Å²	59.5	24%	0.243	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	142.9	-174.6	-160.7	-112.1	0	0	0	112.6	A55 R56 D58 A117 Y128 V129	A55-Y115 WeakPolarHBondContact O-CB 3.49Å; R56-Y115 HydrophobicContact CB-CD2 3.66Å; R56-Y115 HydrophobicContact CB-CE2 4.26Å; R56-Y115 HydrophobicContact CB-CG 3.81Å; D58-Y115 PolarHBondContact OD1-OH 3.25Å; D58-Y115 PolarHBondContact OD2-OH 2.96Å; Y115-A117 HydrophobicContact CD1-CB 4.43Å; Y115-A117 HydrophobicContact CE1-CB 4.33Å; Y115-Y128 CarbonylContact O-C 3.59Å; Y115-Y128 WeakPolarHBondContact O-CA 3.43Å; Y115-Y128 WeakPolarHBondContact O-CB 3.27Å; Y115-V129 PolarHBondContact O-N 2.89Å
116	I	98.2	Very high	97.4	Very high	37 Å²	37	55.7 Å²	55.7	19%	0.19	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.8	173.4	-50.4	-56.9	0	0	0	108.1	I113 F126 Y128 I151 L154 F158	I113-I116 HydrophobicContact CG2-CD1 3.79Å; I116-F126 HydrophobicContact CG2-CD2 4.42Å; I116-Y128 VanDerWaalsContact CD1-CB 3.43Å; I116-Y128 HydrophobicContact CD1-CG 4.45Å; I116-I151 HydrophobicContact CG2-CG1 4.4Å; I116-I151 HydrophobicContact CG2-CG2 4.22Å; I116-L154 HydrophobicContact CD1-CD1 3.86Å; I116-L154 HydrophobicContact CG1-CB 4.39Å; I116-L154 HydrophobicContact CG1-CD1 4.35Å; I116-L154 HydrophobicContact CG2-CD1 4.26Å; I116-F158 HydrophobicContact CD1-CE2 3.88Å; I116-F158 HydrophobicContact CD1-CZ 4.29Å; I116-F158 HydrophobicContact CG1-CE2 3.83Å
117	A	97.9	Very high	97.5	Very high	7 Å²	7	53.3 Å²	53.3	6%	0.058	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	128.4	-179.7	0	0	0	0	0	111	C61 Y115 F126 G127 F138	C61-A117 HydrophobicContact CB-CB 3.39Å; Y115-A117 HydrophobicContact CD1-CB 4.43Å; Y115-A117 HydrophobicContact CE1-CB 4.33Å; A117-F126 CarbonylContact O-C 3.46Å; A117-F126 WeakPolarHBondContact O-CA 3.47Å; A117-F126 WeakPolarHBondContact O-CB 3.43Å; A117-G127 PolarHBondContact N-O 2.85Å; A117-G127 PolarHBondContact O-N 3.28Å; A117-F138 HydrophobicContact CB-CE2 4.27Å
118	K	97.7	Very high	97.5	Very high	110 Å²	110	49 Å²	49	48%	0.478	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	138	168.4	-175	176.6	178.4	177.5	0	108.6	I120 I151	K118-I120 PolarHBondContact O-N 2.83Å; K118-I151 HydrophobicContact CB-CD1 3.87Å; K118-I151 HydrophobicContact CD-CD1 4.39Å; K118-I151 HydrophobicContact CG-CD1 3.93Å
119	D	97.8	Very high	97.5	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.016	24%	0.241	C	C	.	.			trans	-79.7	122.2	171.6	-170.6	-15.9	0	0	0	110.4	Q62 M65 K69 T121 A125	Q62-D119 PolarHBondContact NE2-OD1 3.32Å; Q62-D119 VanDerWaalsContact NE2-OD1 3.1Å; M65-D119 HydrophobicContact CE-CB 4.5Å; M65-D119 HydrophobicContact CG-CB 4.46Å; M65-D119 VanDerWaalsContact CG-OD2 3.29Å; M65-D119 WeakPolarHBondContact CG-OD2 3.33Å; K69-D119 WeakPolarHBondContact CE-OD2 3.45Å; K69-D119 IonicContact NZ-OD1 3.13Å; K69-D119 IonicContact NZ-OD2 2.81Å; K69-D119 PolarHBondContact NZ-OD2 3.41Å; D119-T121 PolarHBondContact O-N 3.13Å; D119-T121 WeakPolarHBondContact OD1-CB 3.46Å; D119-T121 PolarHBondContact OD1-N 3.42Å; D119-T121 PolarHBondContact OD1-OG1 2.86Å; D119-T121 PolarHBondContact OD2-OG1 2.81Å; D119-A125 HydrophobicContact CB-CB 3.81Å; D119-A125 WeakPolarHBondContact CB-O 3.34Å; D119-A125 PolarHBondContact N-O 2.86Å
120	I	95	Very high	97.5	Very high	145 Å²	145	47.7 Å²	47.7	74%	0.744	23%	0.234	S	C	*	.	S	Bend	trans	-71.6	-20.2	178.8	63	176.9	0	0	0	112.6	Q62 K118	Q62-I120 HydrophobicContact CG-CD1 4.41Å; Q62-I120 HydrophobicContact CG-CG1 4.5Å; K118-I120 PolarHBondContact O-N 2.83Å
121	T	96.5	Very high	97.4	Very high	86 Å²	86	47.3 Å²	47.3	53%	0.528	24%	0.235	S	C	.	.	S	Bend	trans	-96.2	-16.1	-176.2	68.9	0	0	0	0	113.7	M66 K69 D119	M66-T121 HydrophobicContact CE-CG2 4.3Å; K69-T121 PolarHBondContact NZ-OG1 3.02Å; K69-T121 VanDerWaalsContact NZ-OG1 3.12Å; D119-T121 PolarHBondContact O-N 3.13Å; D119-T121 WeakPolarHBondContact OD1-CB 3.46Å; D119-T121 PolarHBondContact OD1-N 3.42Å; D119-T121 PolarHBondContact OD1-OG1 2.86Å; D119-T121 PolarHBondContact OD2-OG1 2.81Å
122	D	97.3	Very high	97.2	Very high	24 Å²	24	47.7 Å²	47.7	13%	0.128	24%	0.235	C	C	.	.			trans	-146.6	107.4	-178.6	-175.1	-6.9	0	0	0	110.2	R124 A125 K142	D122-R124 PolarHBondContact O-N 2.98Å; D122-R124 WeakPolarHBondContact OD1-CB 3.35Å; D122-R124 PolarHBondContact OD1-N 2.97Å; D122-A125 HydrophobicContact CB-CB 3.9Å; D122-A125 PolarHBondContact O-N 2.84Å; D122-K142 IonicContact OD2-NZ 3.4Å; D122-K142 PolarHBondContact OD2-NZ 3.24Å
123	H	97.9	Very high	96.7	Very high	126 Å²	126	54 Å²	54	58%	0.583	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-9.3	179.9	71.9	-82.4	0	0	0	114.4	A147	H123-A147 PolarHBondContact O-N 3.25Å
124	R	98.3	Very high	96.2	Very high	97 Å²	97	57 Å²	57	37%	0.366	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	12.7	173.6	-54.6	-173.1	-66.4	177.5	-8.4	112.5	D122 K142 T143 Q145	D122-R124 PolarHBondContact O-N 2.98Å; D122-R124 WeakPolarHBondContact OD1-CB 3.35Å; D122-R124 PolarHBondContact OD1-N 2.97Å; R124-K142 CarbonylContact O-C 3.55Å; R124-K142 WeakPolarHBondContact O-CA 3.03Å; R124-T143 PolarHBondContact O-N 3.02Å; R124-T143 PolarHBondContact O-OG1 3.44Å; R124-Q145 WeakPolarHBondContact CB-O 3.27Å; R124-Q145 WeakPolarHBondContact CG-O 3.5Å
125	A	98.4	Very high	96.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.8	174.7	0	0	0	0	0	110.5	I47 M65 D119 D122 I141	I47-A125 HydrophobicContact CD1-CB 4.33Å; M65-A125 HydrophobicContact CE-CB 4.47Å; D119-A125 HydrophobicContact CB-CB 3.81Å; D119-A125 WeakPolarHBondContact CB-O 3.34Å; D119-A125 PolarHBondContact N-O 2.86Å; D122-A125 HydrophobicContact CB-CB 3.9Å; D122-A125 PolarHBondContact O-N 2.84Å; A125-I141 WeakPolarHBondContact CA-O 3.42Å
126	F	98.7	Very high	96.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	168.2	169.7	78.9	-77.8	0	0	0	107.7	M65 L87 I116 A117 Y128 I141 T143 A147 V150 I151 L154	M65-F126 WeakPolarHBondContact CE-O 3.36Å; L87-F126 HydrophobicContact CD1-CZ 4.03Å; I116-F126 HydrophobicContact CG2-CD2 4.42Å; A117-F126 CarbonylContact O-C 3.46Å; A117-F126 WeakPolarHBondContact O-CA 3.47Å; A117-F126 WeakPolarHBondContact O-CB 3.43Å; F126-Y128 HydrophobicContact CE2-CD1 4.3Å; F126-I141 HydrophobicContact CD1-CB 4.12Å; F126-I141 HydrophobicContact CD1-CG2 4.37Å; F126-I141 HydrophobicContact CE1-CB 3.68Å; F126-I141 HydrophobicContact CE1-CG1 4.41Å; F126-I141 HydrophobicContact CE1-CG2 3.64Å; F126-I141 HydrophobicContact CZ-CB 4.01Å; F126-I141 HydrophobicContact CZ-CG1 4.23Å; F126-I141 HydrophobicContact CZ-CG2 4.16Å; F126-I141 PolarHBondContact N-O 3.33Å; F126-I141 PolarHBondContact O-N 3.45Å; F126-I141 VanDerWaalsContact O-O 3.04Å; F126-T143 HydrophobicContact CD1-CG2 3.97Å; F126-T143 HydrophobicContact CE1-CG2 3.69Å; F126-A147 HydrophobicContact CB-CB 4.11Å; F126-A147 HydrophobicContact CD1-CB 3.89Å; F126-A147 HydrophobicContact CG-CB 4.39Å; F126-V150 HydrophobicContact CE1-CB 4.22Å; F126-V150 HydrophobicContact CE1-CG1 3.84Å; F126-V150 HydrophobicContact CE2-CG1 4.29Å; F126-V150 HydrophobicContact CZ-CB 4.35Å; F126-V150 HydrophobicContact CZ-CG1 3.56Å; F126-I151 HydrophobicContact CB-CD1 3.8Å; F126-I151 HydrophobicContact CB-CG1 3.95Å; F126-I151 HydrophobicContact CD2-CG1 4.22Å; F126-I151 HydrophobicContact CG-CD1 4.48Å; F126-I151 HydrophobicContact CG-CG1 4.11Å; F126-L154 HydrophobicContact CE2-CD1 3.9Å
127	G	98.5	Very high	96.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	173.6	169.1	0	0	0	0	0	111.7	A117 V139	A117-G127 PolarHBondContact N-O 2.85Å; A117-G127 PolarHBondContact O-N 3.28Å; G127-V139 CarbonylContact C-O 3.42Å; G127-V139 WeakPolarHBondContact CA-O 3.33Å
128	Y	98.7	Very high	96.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	148.9	173.7	62.4	-90.8	0	0	0	110.5	I94 H108 I113 Y115 I116 F126 C130 F138 V139 I141	I94-Y128 HydrophobicContact CD1-CD1 3.74Å; I94-Y128 HydrophobicContact CD1-CD2 4.13Å; I94-Y128 HydrophobicContact CD1-CE1 3.74Å; I94-Y128 HydrophobicContact CD1-CE2 4.15Å; I94-Y128 HydrophobicContact CD1-CG 3.94Å; I94-Y128 HydrophobicContact CG2-CE1 4.07Å; H108-Y128 PolarHBondContact CE1-OH 2.92Å; H108-Y128 VanDerWaalsContact CE1-OH 3.24Å; H108-Y128 AromaticContact ND1-CE2 3.61Å; H108-Y128 AromaticContact ND1-CZ 3.69Å; H108-Y128 PolarHBondContact ND1-OH 2.82Å; I113-Y128 HydrophobicContact CG1-CD2 4.42Å; I113-Y128 HydrophobicContact CG2-CD2 4.29Å; Y115-Y128 CarbonylContact O-C 3.59Å; Y115-Y128 WeakPolarHBondContact O-CA 3.43Å; Y115-Y128 WeakPolarHBondContact O-CB 3.27Å; I116-Y128 VanDerWaalsContact CD1-CB 3.43Å; I116-Y128 HydrophobicContact CD1-CG 4.45Å; F126-Y128 HydrophobicContact CE2-CD1 4.3Å; Y128-C130 HydrophobicContact CD2-CB 4.15Å; Y128-C130 HydrophobicContact CE2-CB 4.12Å; Y128-F138 WeakPolarHBondContact O-CA 3.14Å; Y128-V139 HydrophobicContact CD1-CB 4.26Å; Y128-V139 HydrophobicContact CD2-CB 4.34Å; Y128-V139 HydrophobicContact CD2-CG2 4.45Å; Y128-V139 HydrophobicContact CE1-CB 3.77Å; Y128-V139 HydrophobicContact CE1-CG1 3.86Å; Y128-V139 HydrophobicContact CE2-CB 3.85Å; Y128-V139 HydrophobicContact CE2-CG2 3.75Å; Y128-V139 PolarHBondContact N-O 3.27Å; Y128-V139 PolarHBondContact O-N 3.08Å; Y128-I141 HydrophobicContact CE1-CG1 4.4Å
129	V	98.4	Very high	96.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.8	172.3	-175	0	0	0	0	108.2	V52 A55 L60 S114 Y115 H136 R137 F138	V52-V129 HydrophobicContact CG2-CG1 4.02Å; A55-V129 WeakPolarHBondContact O-CG1 3.4Å; L60-V129 HydrophobicContact CD2-CG2 4.48Å; S114-V129 PolarHBondContact N-O 2.99Å; S114-V129 WeakPolarHBondContact OG-CB 3.43Å; S114-V129 WeakPolarHBondContact OG-CG1 3.35Å; S114-V129 PolarHBondContact OG-O 2.92Å; Y115-V129 PolarHBondContact O-N 2.89Å; V129-H136 HydrophobicContact CG1-CB 4.07Å; V129-R137 CarbonylContact C-O 3.57Å; V129-R137 WeakPolarHBondContact CA-O 3.4Å; V129-F138 HydrophobicContact CG2-CD2 3.94Å
130	C	97.8	Very high	96.2	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	161.6	174.4	61.5	0	0	0	0	112.2	H108 E112 I113 Y128 H136 R137	H108-C130 HydrophobicContact CB-CB 4.33Å; H108-C130 VanDerWaalsContact CD2-SG 3.59Å; E112-C130 CarbonylContact O-C 3.57Å; E112-C130 WeakPolarHBondContact O-CA 3.32Å; E112-C130 WeakPolarHBondContact O-CB 3.43Å; I113-C130 HydrophobicContact CG1-CB 4.32Å; Y128-C130 HydrophobicContact CD2-CB 4.15Å; Y128-C130 HydrophobicContact CE2-CB 4.12Å; C130-H136 WeakPolarHBondContact O-CA 3.42Å; C130-R137 PolarHBondContact N-O 2.98Å; C130-R137 PolarHBondContact O-N 3.32Å
131	G	94.2	Very high	96.4	Very high	19 Å²	19	46.6 Å²	46.6	20%	0.196	24%	0.243	C	C	.	.	S	Bend	trans	117.4	168.9	175.6	0	0	0	0	0	113	E112 N135 H136	E112-G131 PolarHBondContact O-N 3.36Å; G131-N135 WeakPolarHBondContact CA-O 3.36Å; G131-H136 PolarHBondContact O-ND1 3.44Å
132	K	90.4	Very high	96.5	Very high	159 Å²	159	44.8 Å²	44.8	69%	0.691	23%	0.228	S	C	*	.	S	Bend	trans	-81.7	167.1	-179.5	-63.1	-175.5	-179.6	-179.5	0	110.7	G134 N135 H136	K132-G134 PolarHBondContact O-N 2.73Å; K132-N135 CarbonylContact O-C 3.56Å; K132-N135 PolarHBondContact O-N 2.89Å; K132-H136 PolarHBondContact O-CE1 2.78Å; K132-H136 VanDerWaalsContact O-CE1 3.31Å; K132-H136 PolarHBondContact O-ND1 2.96Å
133	E	86.6	Confident	96.5	Very high	191 Å²	191	44 Å²	44	89%	0.893	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	128	176.1	-168.4	167.3	-161.7	0	0	110.9	N135	E133-N135 VanDerWaalsContact C-N 3.32Å; E133-N135 PolarHBondContact O-N 2.93Å
134	G	87.4	Confident	96.5	Very high	78 Å²	78	40.2 Å²	40.2	80%	0.804	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.8	-5.6	-175.9	0	0	0	0	0	116	K132	K132-G134 PolarHBondContact O-N 2.73Å
135	N	94.2	Very high	96.4	Very high	88 Å²	88	42.8 Å²	42.8	47%	0.471	23%	0.23	S	C	.	.			trans	-139	63.1	175.4	-172.2	-4.4	0	0	0	110.7	G131 K132 E133	G131-N135 WeakPolarHBondContact CA-O 3.36Å; K132-N135 CarbonylContact O-C 3.56Å; K132-N135 PolarHBondContact O-N 2.89Å; E133-N135 VanDerWaalsContact C-N 3.32Å; E133-N135 PolarHBondContact O-N 2.93Å
136	H	97.8	Very high	96.3	Very high	22 Å²	22	44.7 Å²	44.7	10%	0.102	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	136.5	176.4	-58.7	-58.5	0	0	0	110.7	V52 A55 V129 C130 G131 K132	V52-H136 HydrophobicContact CG2-CB 3.68Å; V52-H136 PolarHBondContact N-O 3.27Å; A55-H136 PolarHBondContact N-CD2 3.19Å; V129-H136 HydrophobicContact CG1-CB 4.07Å; C130-H136 WeakPolarHBondContact O-CA 3.42Å; G131-H136 PolarHBondContact O-ND1 3.44Å; K132-H136 PolarHBondContact O-CE1 2.78Å; K132-H136 VanDerWaalsContact O-CE1 3.31Å; K132-H136 PolarHBondContact O-ND1 2.96Å
137	R	98.1	Very high	96.3	Very high	86 Å²	86	44.8 Å²	44.8	33%	0.325	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.4	176.9	-72.5	177.8	-79.1	154.2	-1.4	109.8	I49 D50 E51 V129 C130	I49-R137 HydrophobicContact CG2-CB 4Å; I49-R137 HydrophobicContact CG2-CG 4.34Å; D50-R137 CarbonylContact O-C 3.37Å; D50-R137 VanDerWaalsContact O-CA 3.23Å; D50-R137 WeakPolarHBondContact O-CA 3.49Å; E51-R137 HydrophobicContact CG-CG 4.31Å; V129-R137 CarbonylContact C-O 3.57Å; V129-R137 WeakPolarHBondContact CA-O 3.4Å; C130-R137 PolarHBondContact N-O 2.98Å; C130-R137 PolarHBondContact O-N 3.32Å
138	F	98.6	Very high	96.2	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.5	170.1	-178.1	-107.7	0	0	0	109.7	I49 D50 V52 C61 S64 M65 L68 A117 Y128 V129 A140	I49-F138 WeakPolarHBondContact CA-O 3.41Å; D50-F138 PolarHBondContact N-O 2.98Å; D50-F138 PolarHBondContact O-N 2.62Å; V52-F138 HydrophobicContact CG1-CB 3.63Å; V52-F138 HydrophobicContact CG2-CB 4.41Å; C61-F138 HydrophobicContact CB-CD2 4.15Å; C61-F138 HydrophobicContact CB-CE2 3.57Å; C61-F138 HydrophobicContact CB-CZ 4.03Å; C61-F138 WeakPolarHBondContact O-CZ 3.36Å; S64-F138 VanDerWaalsContact OG-CD1 3.22Å; S64-F138 WeakPolarHBondContact OG-CD1 3.07Å; M65-F138 HydrophobicContact CB-CE1 3.92Å; M65-F138 HydrophobicContact CB-CZ 4.27Å; M65-F138 HydrophobicContact CE-CE1 3.97Å; M65-F138 HydrophobicContact CE-CZ 3.91Å; L68-F138 HydrophobicContact CD1-CD1 4.19Å; A117-F138 HydrophobicContact CB-CE2 4.27Å; Y128-F138 WeakPolarHBondContact O-CA 3.14Å; V129-F138 HydrophobicContact CG2-CD2 3.94Å; F138-A140 HydrophobicContact CD1-CB 4.31Å; F138-A140 HydrophobicContact CE1-CB 3.86Å
139	V	98.7	Very high	96.2	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.5	177.4	-175.9	0	0	0	0	108.7	L46 I49 I96 G127 Y128 I141	L46-V139 HydrophobicContact CD1-CG1 4.1Å; I49-V139 HydrophobicContact CG1-CG1 4.27Å; I49-V139 HydrophobicContact CG1-CG2 4.22Å; I49-V139 HydrophobicContact CG2-CG2 4.33Å; I96-V139 HydrophobicContact CD1-CG1 3.98Å; G127-V139 CarbonylContact C-O 3.42Å; G127-V139 WeakPolarHBondContact CA-O 3.33Å; Y128-V139 HydrophobicContact CD1-CB 4.26Å; Y128-V139 HydrophobicContact CD2-CB 4.34Å; Y128-V139 HydrophobicContact CD2-CG2 4.45Å; Y128-V139 HydrophobicContact CE1-CB 3.77Å; Y128-V139 HydrophobicContact CE1-CG1 3.86Å; Y128-V139 HydrophobicContact CE2-CB 3.85Å; Y128-V139 HydrophobicContact CE2-CG2 3.75Å; Y128-V139 PolarHBondContact N-O 3.27Å; Y128-V139 PolarHBondContact O-N 3.08Å; V139-I141 HydrophobicContact CG1-CD1 3.88Å; V139-I141 HydrophobicContact CG1-CG1 4.3Å
140	A	98.7	Very high	96.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.4	-177.1	0	0	0	0	0	111.6	I47 G48 M65 L68 F138	I47-A140 HydrophobicContact CB-CB 3.81Å; I47-A140 WeakPolarHBondContact CB-O 3.36Å; I47-A140 HydrophobicContact CD1-CB 4.21Å; I47-A140 HydrophobicContact CG1-CB 4.46Å; I47-A140 HydrophobicContact CG2-CB 4.27Å; I47-A140 PolarHBondContact N-O 3.48Å; G48-A140 PolarHBondContact N-O 2.89Å; G48-A140 PolarHBondContact O-N 3.32Å; M65-A140 HydrophobicContact CE-CB 3.69Å; M65-A140 HydrophobicContact SD-CB 3.8Å; L68-A140 HydrophobicContact CD1-CB 3.56Å; F138-A140 HydrophobicContact CD1-CB 4.31Å; F138-A140 HydrophobicContact CE1-CB 3.86Å
141	I	98.8	Very high	96.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134	-172.6	-55.6	-64.2	0	0	0	110	A44 L46 I85 L87 I96 A125 F126 Y128 V139	A44-I141 HydrophobicContact CB-CG2 3.61Å; L46-I141 HydrophobicContact CD1-CD1 3.85Å; I85-I141 HydrophobicContact CD1-CD1 3.86Å; L87-I141 HydrophobicContact CD1-CD1 4.47Å; L87-I141 HydrophobicContact CD1-CG1 4.22Å; L87-I141 HydrophobicContact CD1-CG2 4.41Å; I96-I141 HydrophobicContact CD1-CD1 4.06Å; A125-I141 WeakPolarHBondContact CA-O 3.42Å; F126-I141 HydrophobicContact CD1-CB 4.12Å; F126-I141 HydrophobicContact CD1-CG2 4.37Å; F126-I141 HydrophobicContact CE1-CB 3.68Å; F126-I141 HydrophobicContact CE1-CG1 4.41Å; F126-I141 HydrophobicContact CE1-CG2 3.64Å; F126-I141 HydrophobicContact CZ-CB 4.01Å; F126-I141 HydrophobicContact CZ-CG1 4.23Å; F126-I141 HydrophobicContact CZ-CG2 4.16Å; F126-I141 PolarHBondContact N-O 3.33Å; F126-I141 PolarHBondContact O-N 3.45Å; F126-I141 VanDerWaalsContact O-O 3.04Å; Y128-I141 HydrophobicContact CE1-CG1 4.4Å; V139-I141 HydrophobicContact CG1-CD1 3.88Å; V139-I141 HydrophobicContact CG1-CG1 4.3Å
142	K	98.4	Very high	96.3	Very high	47 Å²	47	55.6 Å²	55.6	20%	0.204	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	109.8	169.2	-171.2	177.2	-174.1	94	0	109.8	A44 K45 I47 D122 R124	A44-K142 CarbonylContact C-O 3.56Å; A44-K142 VanDerWaalsContact CA-O 3.27Å; A44-K142 WeakPolarHBondContact CA-O 3.36Å; A44-K142 WeakPolarHBondContact CB-O 3.35Å; K45-K142 HydrophobicContact CB-CB 4.49Å; K45-K142 PolarHBondContact N-O 3.47Å; K45-K142 PolarHBondContact O-N 3.09Å; I47-K142 HydrophobicContact CD1-CB 4.01Å; I47-K142 HydrophobicContact CG1-CB 3.87Å; D122-K142 IonicContact OD2-NZ 3.4Å; D122-K142 PolarHBondContact OD2-NZ 3.24Å; R124-K142 CarbonylContact O-C 3.55Å; R124-K142 WeakPolarHBondContact O-CA 3.03Å
143	T	98.4	Very high	96.7	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.043	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	152.5	178.6	51.2	0	0	0	0	111.5	R124 F126 Q145 A147 V150	R124-T143 PolarHBondContact O-N 3.02Å; R124-T143 PolarHBondContact O-OG1 3.44Å; F126-T143 HydrophobicContact CD1-CG2 3.97Å; F126-T143 HydrophobicContact CE1-CG2 3.69Å; T143-Q145 VanDerWaalsContact C-N 3.32Å; T143-Q145 CarbonylContact C-O 3.45Å; T143-Q145 WeakPolarHBondContact CB-O 3.45Å; T143-Q145 PolarHBondContact OG1-O 2.9Å; T143-A147 HydrophobicContact CG2-CB 4.22Å; T143-A147 WeakPolarHBondContact OG1-CA 3.37Å; T143-A147 PolarHBondContact OG1-N 2.86Å; T143-V150 HydrophobicContact CG2-CG2 3.91Å
144	A	97.1	Very high	97.2	Very high	47 Å²	47	39.1 Å²	39.1	39%	0.388	23%	0.225	S	C	.	.	S	Bend	trans	-65.2	-39.8	175.5	0	0	0	0	0	111.8	K43	K43-A144 HydrophobicContact CB-CB 3.96Å; K43-A144 WeakPolarHBondContact O-CB 3.13Å; K43-A144 PolarHBondContact O-N 2.86Å
145	Q	95.8	Very high	97.7	Very high	151 Å²	151	41.9 Å²	41.9	71%	0.706	21%	0.212	S	C	*	.	S	Bend	trans	-108.8	-161.8	174.9	-59.4	-57.6	-32.2	0	0	109.9	R124 T143	R124-Q145 WeakPolarHBondContact CB-O 3.27Å; R124-Q145 WeakPolarHBondContact CG-O 3.5Å; T143-Q145 VanDerWaalsContact C-N 3.32Å; T143-Q145 CarbonylContact C-O 3.45Å; T143-Q145 WeakPolarHBondContact CB-O 3.45Å; T143-Q145 PolarHBondContact OG1-O 2.9Å
146	A	97.7	Very high	97.9	Very high	41 Å²	41	38.3 Å²	38.3	34%	0.339	19%	0.192	S	C	.	.			trans	-56.1	143.1	172.3	0	0	0	0	0	111.8	E148 P149	A146-E148 VanDerWaalsContact C-N 3.35Å; A146-P149 WeakPolarHBondContact O-CD 3.33Å
147	A	98.1	Very high	97.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.008	19%	0.188	C	C	.	.	S	Bend	trans	-80	-19.9	178.4	0	0	0	0	0	112.8	H123 F126 T143 V150 I151	H123-A147 PolarHBondContact O-N 3.25Å; F126-A147 HydrophobicContact CB-CB 4.11Å; F126-A147 HydrophobicContact CD1-CB 3.89Å; F126-A147 HydrophobicContact CG-CB 4.39Å; T143-A147 HydrophobicContact CG2-CB 4.22Å; T143-A147 WeakPolarHBondContact OG1-CA 3.37Å; T143-A147 PolarHBondContact OG1-N 2.86Å; A147-V150 WeakPolarHBondContact O-CB 3.38Å; A147-V150 PolarHBondContact O-N 2.86Å; A147-I151 HydrophobicContact CB-CD1 4.37Å; A147-I151 WeakPolarHBondContact O-CG1 3.41Å; A147-I151 PolarHBondContact O-N 3.07Å; A147-I151 VanDerWaalsContact O-N 3.08Å
148	E	97.6	Very high	97.8	Very high	107 Å²	107	35.6 Å²	35.6	50%	0.5	18%	0.183	S	C	.	.	H	α-helix	trans	-55.9	-43.3	-174.7	-178.9	162.2	-140.4	0	0	114.7	A146 V150 I151 L152	A146-E148 VanDerWaalsContact C-N 3.35Å; E148-V150 VanDerWaalsContact C-N 3.26Å; E148-V150 PolarHBondContact O-N 3.06Å; E148-I151 PolarHBondContact O-N 3.27Å; E148-L152 HydrophobicContact CG-CD1 3.92Å; E148-L152 HydrophobicContact CG-CG 4.36Å; E148-L152 WeakPolarHBondContact O-CB 3.39Å; E148-L152 VanDerWaalsContact O-CG 3.25Å; E148-L152 WeakPolarHBondContact O-CG 3.39Å; E148-L152 PolarHBondContact O-N 2.93Å
149	P	97.6	Very high	97.7	Very high	62 Å²	62	40.1 Å²	40.1	40%	0.403	20%	0.204	S	C	.	.	H	α-helix	trans	-59	-36.8	174.5	-24.8	35.6	0	0	0	113.5	A146 L152 D153	A146-P149 WeakPolarHBondContact O-CD 3.33Å; P149-L152 PolarHBondContact O-N 2.8Å; P149-D153 PolarHBondContact O-N 2.98Å
150	V	98.1	Very high	97.6	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-68.8	-44.7	179.2	-169.4	0	0	0	0	110.7	Y42 L87 I89 F126 T143 A147 E148 L152 D153 L154	Y42-V150 HydrophobicContact CD1-CG2 3.62Å; Y42-V150 HydrophobicContact CD2-CG1 4.18Å; Y42-V150 HydrophobicContact CD2-CG2 3.94Å; Y42-V150 HydrophobicContact CE1-CG2 3.81Å; Y42-V150 HydrophobicContact CE2-CG1 4.41Å; Y42-V150 HydrophobicContact CE2-CG2 4.11Å; Y42-V150 HydrophobicContact CG-CG2 3.67Å; L87-V150 HydrophobicContact CD2-CG1 3.93Å; I89-V150 HydrophobicContact CD1-CG1 3.61Å; F126-V150 HydrophobicContact CE1-CB 4.22Å; F126-V150 HydrophobicContact CE1-CG1 3.84Å; F126-V150 HydrophobicContact CE2-CG1 4.29Å; F126-V150 HydrophobicContact CZ-CB 4.35Å; F126-V150 HydrophobicContact CZ-CG1 3.56Å; T143-V150 HydrophobicContact CG2-CG2 3.91Å; A147-V150 WeakPolarHBondContact O-CB 3.38Å; A147-V150 PolarHBondContact O-N 2.86Å; E148-V150 VanDerWaalsContact C-N 3.26Å; E148-V150 PolarHBondContact O-N 3.06Å; V150-L152 VanDerWaalsContact C-N 3.3Å; V150-L152 PolarHBondContact O-N 2.67Å; V150-D153 PolarHBondContact O-N 3.28Å; V150-L154 WeakPolarHBondContact O-CG 3.34Å; V150-L154 PolarHBondContact O-N 2.94Å
151	I	98.1	Very high	97.5	Very high	34 Å²	34	41.5 Å²	41.5	17%	0.174	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-41.8	177	-63.3	168.3	0	0	0	110.4	I116 K118 F126 A147 E148 L154 R155	I116-I151 HydrophobicContact CG2-CG1 4.4Å; I116-I151 HydrophobicContact CG2-CG2 4.22Å; K118-I151 HydrophobicContact CB-CD1 3.87Å; K118-I151 HydrophobicContact CD-CD1 4.39Å; K118-I151 HydrophobicContact CG-CD1 3.93Å; F126-I151 HydrophobicContact CB-CD1 3.8Å; F126-I151 HydrophobicContact CB-CG1 3.95Å; F126-I151 HydrophobicContact CD2-CG1 4.22Å; F126-I151 HydrophobicContact CG-CD1 4.48Å; F126-I151 HydrophobicContact CG-CG1 4.11Å; A147-I151 HydrophobicContact CB-CD1 4.37Å; A147-I151 WeakPolarHBondContact O-CG1 3.41Å; A147-I151 PolarHBondContact O-N 3.07Å; A147-I151 VanDerWaalsContact O-N 3.08Å; E148-I151 PolarHBondContact O-N 3.27Å; I151-L154 PolarHBondContact O-N 3.49Å; I151-R155 PolarHBondContact O-N 2.92Å
152	L	97.4	Very high	97.3	Very high	43 Å²	43	47.8 Å²	47.8	23%	0.225	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-39.8	178.3	-72.6	172.9	0	0	0	112.3	E148 P149 V150 R155 D156	E148-L152 HydrophobicContact CG-CD1 3.92Å; E148-L152 HydrophobicContact CG-CG 4.36Å; E148-L152 WeakPolarHBondContact O-CB 3.39Å; E148-L152 VanDerWaalsContact O-CG 3.25Å; E148-L152 WeakPolarHBondContact O-CG 3.39Å; E148-L152 PolarHBondContact O-N 2.93Å; P149-L152 PolarHBondContact O-N 2.8Å; V150-L152 VanDerWaalsContact C-N 3.3Å; V150-L152 PolarHBondContact O-N 2.67Å; L152-R155 PolarHBondContact O-N 2.87Å; L152-D156 WeakPolarHBondContact O-CB 3.49Å; L152-D156 PolarHBondContact O-N 3Å
153	D	98	Very high	97.1	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-40	173.7	-87.1	-18.3	0	0	0	111.9	R34 F35 Y42 I89 P149 V150 D156 L157	R34-D153 IonicContact CZ-OD1 2.67Å; R34-D153 IonicContact CZ-OD2 2.66Å; R34-D153 IonicContact NE-OD1 2.54Å; R34-D153 PolarHBondContact NE-OD1 2.83Å; R34-D153 IonicContact NE-OD2 2.83Å; R34-D153 IonicContact NH2-OD1 3.95Å; R34-D153 PolarHBondContact NH2-OD1 2.84Å; R34-D153 VanDerWaalsContact NH2-OD1 3.13Å; R34-D153 IonicContact NH2-OD2 3.41Å; R34-D153 PolarHBondContact NH2-OD2 2.89Å; F35-D153 HydrophobicContact CE1-CB 4.03Å; F35-D153 HydrophobicContact CZ-CB 4.11Å; F35-D153 VanDerWaalsContact CZ-O 3.25Å; F35-D153 WeakPolarHBondContact CZ-O 3.44Å; Y42-D153 WeakPolarHBondContact CE2-OD2 3.4Å; Y42-D153 PolarHBondContact OH-OD2 3.43Å; I89-D153 HydrophobicContact CD1-CB 4.08Å; P149-D153 PolarHBondContact O-N 2.98Å; V150-D153 PolarHBondContact O-N 3.28Å; D153-D156 PolarHBondContact O-N 2.82Å; D153-L157 VanDerWaalsContact O-CB 3.29Å; D153-L157 WeakPolarHBondContact O-CB 3.45Å; D153-L157 PolarHBondContact O-N 3.31Å
154	L	97.9	Very high	96.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-43.4	176.1	-72.5	169.2	0	0	0	111.9	I89 I94 I116 F126 V150 I151 L157 F158	I89-L154 HydrophobicContact CD1-CD1 4.45Å; I89-L154 HydrophobicContact CD1-CD2 3.83Å; I89-L154 HydrophobicContact CD1-CG 3.73Å; I89-L154 HydrophobicContact CG1-CD2 3.9Å; I89-L154 HydrophobicContact CG1-CG 4.37Å; I89-L154 HydrophobicContact CG2-CD2 3.98Å; I94-L154 HydrophobicContact CD1-CD1 4.19Å; I94-L154 HydrophobicContact CD1-CD2 3.64Å; I94-L154 HydrophobicContact CG1-CD2 3.75Å; I116-L154 HydrophobicContact CD1-CD1 3.86Å; I116-L154 HydrophobicContact CG1-CB 4.39Å; I116-L154 HydrophobicContact CG1-CD1 4.35Å; I116-L154 HydrophobicContact CG2-CD1 4.26Å; F126-L154 HydrophobicContact CE2-CD1 3.9Å; V150-L154 WeakPolarHBondContact O-CG 3.34Å; V150-L154 PolarHBondContact O-N 2.94Å; I151-L154 PolarHBondContact O-N 3.49Å; L154-L157 PolarHBondContact O-N 3.45Å; L154-F158 HydrophobicContact CB-CE2 4.45Å; L154-F158 HydrophobicContact CD2-CZ 4.28Å; L154-F158 WeakPolarHBondContact O-CD2 3.34Å; L154-F158 VanDerWaalsContact O-CG 3.23Å; L154-F158 WeakPolarHBondContact O-CG 3.11Å; L154-F158 PolarHBondContact O-N 2.85Å
155	R	96.8	Very high	96.6	Very high	137 Å²	137	54.8 Å²	54.8	52%	0.517	26%	0.26	S	S	.	.	H	α-helix	trans	-58.8	-50.1	175.1	-174.4	-166.2	70.9	-178.9	6.2	111.1	I151 L152 L157 F158 Q159	I151-R155 PolarHBondContact O-N 2.92Å; L152-R155 PolarHBondContact O-N 2.87Å; R155-L157 VanDerWaalsContact C-N 3.33Å; R155-L157 PolarHBondContact O-N 3.48Å; R155-F158 PolarHBondContact O-N 2.75Å; R155-Q159 WeakPolarHBondContact O-CB 3.23Å; R155-Q159 PolarHBondContact O-N 2.88Å
156	D	97.5	Very high	96.5	Very high	13 Å²	13	51.2 Å²	51.2	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-37.2	-178.5	-67	-2.6	0	0	0	111.6	R26 L31 F35 L152 D153 L160	R26-D156 WeakPolarHBondContact CD-OD2 3.43Å; R26-D156 IonicContact CZ-OD2 2.61Å; R26-D156 IonicContact NE-OD2 3.55Å; R26-D156 PolarHBondContact NE-OD2 2.9Å; R26-D156 IonicContact NH1-OD1 3.54Å; R26-D156 PolarHBondContact NH1-OD1 3.37Å; R26-D156 IonicContact NH1-OD2 2.76Å; R26-D156 PolarHBondContact NH1-OD2 3.07Å; L31-D156 HydrophobicContact CD1-CB 4.07Å; L31-D156 HydrophobicContact CD2-CB 4Å; F35-D156 HydrophobicContact CE2-CB 4.26Å; F35-D156 HydrophobicContact CZ-CB 4.37Å; L152-D156 WeakPolarHBondContact O-CB 3.49Å; L152-D156 PolarHBondContact O-N 3Å; D153-D156 PolarHBondContact O-N 2.82Å; D156-L160 VanDerWaalsContact O-CB 3.23Å; D156-L160 WeakPolarHBondContact O-CB 3.49Å; D156-L160 PolarHBondContact O-N 3.12Å
157	L	97.8	Very high	96.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-50.1	174.3	173.7	66.2	0	0	0	111.5	F35 I89 S90 F91 V110 D153 L154 R155 L160 I161	F35-L157 HydrophobicContact CB-CD1 3.94Å; F35-L157 HydrophobicContact CD1-CD1 4.43Å; F35-L157 HydrophobicContact CD2-CB 4.18Å; F35-L157 HydrophobicContact CD2-CD1 3.9Å; F35-L157 HydrophobicContact CE1-CB 4.42Å; F35-L157 HydrophobicContact CE2-CB 3.95Å; F35-L157 HydrophobicContact CG-CD1 3.85Å; F35-L157 HydrophobicContact CZ-CB 4.09Å; I89-L157 HydrophobicContact CG2-CB 4.39Å; I89-L157 HydrophobicContact CG2-CD2 3.57Å; S90-L157 VanDerWaalsContact O-CD2 3.24Å; S90-L157 WeakPolarHBondContact O-CD2 3.29Å; F91-L157 HydrophobicContact CD1-CD1 4.14Å; F91-L157 HydrophobicContact CE1-CD1 4.43Å; V110-L157 HydrophobicContact CG2-CD2 4.18Å; D153-L157 VanDerWaalsContact O-CB 3.29Å; D153-L157 WeakPolarHBondContact O-CB 3.45Å; D153-L157 PolarHBondContact O-N 3.31Å; L154-L157 PolarHBondContact O-N 3.45Å; R155-L157 VanDerWaalsContact C-N 3.33Å; R155-L157 PolarHBondContact O-N 3.48Å; L157-L160 PolarHBondContact O-N 2.93Å; L157-I161 HydrophobicContact CD1-CD1 3.64Å; L157-I161 HydrophobicContact CD1-CG1 4.25Å; L157-I161 HydrophobicContact CG-CD1 3.93Å; L157-I161 VanDerWaalsContact O-CG1 3.32Å; L157-I161 WeakPolarHBondContact O-CG1 3.2Å; L157-I161 PolarHBondContact O-N 3.38Å
158	F	96.9	Very high	95.9	Very high	51 Å²	51	58.6 Å²	58.6	22%	0.224	27%	0.266	C	S	.	.	H	α-helix	trans	-66.9	-40.6	-178.1	-61.8	-22.7	0	0	0	111.8	V110 I113 I116 L154 R155 I161 Y162	V110-F158 HydrophobicContact CB-CE1 4.48Å; V110-F158 HydrophobicContact CG1-CD1 3.71Å; V110-F158 HydrophobicContact CG1-CE1 3.84Å; V110-F158 HydrophobicContact CG2-CE1 4.39Å; I113-F158 HydrophobicContact CB-CZ 4.03Å; I113-F158 HydrophobicContact CD1-CE1 4.44Å; I113-F158 HydrophobicContact CD1-CZ 4.14Å; I113-F158 HydrophobicContact CG2-CE2 4.14Å; I113-F158 HydrophobicContact CG2-CZ 3.71Å; I116-F158 HydrophobicContact CD1-CE2 3.88Å; I116-F158 HydrophobicContact CD1-CZ 4.29Å; I116-F158 HydrophobicContact CG1-CE2 3.83Å; L154-F158 HydrophobicContact CB-CE2 4.45Å; L154-F158 HydrophobicContact CD2-CZ 4.28Å; L154-F158 WeakPolarHBondContact O-CD2 3.34Å; L154-F158 VanDerWaalsContact O-CG 3.23Å; L154-F158 WeakPolarHBondContact O-CG 3.11Å; L154-F158 PolarHBondContact O-N 2.85Å; R155-F158 PolarHBondContact O-N 2.75Å; F158-I161 PolarHBondContact O-N 3.18Å; F158-Y162 WeakPolarHBondContact O-CB 3.22Å; F158-Y162 PolarHBondContact O-N 3.29Å
159	Q	96.8	Very high	95.5	Very high	95 Å²	95	58.1 Å²	58.1	44%	0.444	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-47.7	175.3	-174	61	39.9	0	0	111.3	R155 I161 Y162 E163	R155-Q159 WeakPolarHBondContact O-CB 3.23Å; R155-Q159 PolarHBondContact O-N 2.88Å; Q159-I161 PolarHBondContact O-N 2.65Å; Q159-Y162 WeakPolarHBondContact O-CB 3.47Å; Q159-Y162 PolarHBondContact O-N 2.62Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.44Å; Q159-E163 PolarHBondContact NE2-OE1 3.43Å; Q159-E163 WeakPolarHBondContact O-CG 3.41Å; Q159-E163 PolarHBondContact O-N 2.83Å
160	L	96.6	Very high	95.1	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-45.4	177.8	177	64.3	0	0	0	111.9	E28 L31 I32 F35 F91 D156 L157 Y162 E163 L164	E28-L160 HydrophobicContact CG-CD1 3.71Å; L31-L160 HydrophobicContact CB-CD2 3.77Å; I32-L160 HydrophobicContact CG1-CD1 4.24Å; I32-L160 HydrophobicContact CG1-CD2 3.94Å; F35-L160 HydrophobicContact CD2-CD2 4.31Å; F91-L160 HydrophobicContact CE1-CD2 3.91Å; F91-L160 HydrophobicContact CE1-CG 4.43Å; F91-L160 HydrophobicContact CZ-CD2 3.75Å; D156-L160 VanDerWaalsContact O-CB 3.23Å; D156-L160 WeakPolarHBondContact O-CB 3.49Å; D156-L160 PolarHBondContact O-N 3.12Å; L157-L160 PolarHBondContact O-N 2.93Å; L160-Y162 VanDerWaalsContact C-N 3.31Å; L160-Y162 PolarHBondContact O-N 2.54Å; L160-E163 PolarHBondContact O-N 3.4Å; L160-L164 HydrophobicContact CD1-CD1 4.05Å; L160-L164 HydrophobicContact CD1-CG 4.1Å; L160-L164 HydrophobicContact CG-CD1 3.96Å; L160-L164 HydrophobicContact CG-CG 4.39Å; L160-L164 WeakPolarHBondContact O-CB 3.48Å; L160-L164 VanDerWaalsContact O-CG 3.26Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 2.93Å
161	I	95.7	Very high	94.7	Very high	28 Å²	28	66.5 Å²	66.5	14%	0.144	30%	0.301	C	S	.	.	H	α-helix	trans	-64.2	-39.5	179.3	-71.8	170.3	0	0	0	111.1	F91 V110 L157 F158 Q159 K165	F91-I161 HydrophobicContact CD1-CD1 3.93Å; F91-I161 HydrophobicContact CD1-CG1 3.79Å; F91-I161 HydrophobicContact CE1-CG1 3.98Å; V110-I161 HydrophobicContact CB-CD1 4.1Å; V110-I161 HydrophobicContact CG1-CD1 3.75Å; V110-I161 HydrophobicContact CG1-CG2 4.48Å; V110-I161 HydrophobicContact CG2-CD1 3.62Å; L157-I161 HydrophobicContact CD1-CD1 3.64Å; L157-I161 HydrophobicContact CD1-CG1 4.25Å; L157-I161 HydrophobicContact CG-CD1 3.93Å; L157-I161 VanDerWaalsContact O-CG1 3.32Å; L157-I161 WeakPolarHBondContact O-CG1 3.2Å; L157-I161 PolarHBondContact O-N 3.38Å; F158-I161 PolarHBondContact O-N 3.18Å; Q159-I161 PolarHBondContact O-N 2.65Å; I161-K165 HydrophobicContact CG2-CD 4.44Å; I161-K165 WeakPolarHBondContact O-CB 3.5Å; I161-K165 WeakPolarHBondContact O-CG 3.4Å; I161-K165 PolarHBondContact O-N 3.36Å
162	Y	94.8	Very high	94.1	Very high	133 Å²	133	70.2 Å²	70.2	52%	0.522	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-49.3	174.9	175.6	-101.4	0	0	0	111.2	F158 Q159 L160 L164 K165 Q166	F158-Y162 WeakPolarHBondContact O-CB 3.22Å; F158-Y162 PolarHBondContact O-N 3.29Å; Q159-Y162 WeakPolarHBondContact O-CB 3.47Å; Q159-Y162 PolarHBondContact O-N 2.62Å; L160-Y162 VanDerWaalsContact C-N 3.31Å; L160-Y162 PolarHBondContact O-N 2.54Å; Y162-L164 PolarHBondContact O-N 3.06Å; Y162-K165 PolarHBondContact O-N 3.46Å; Y162-Q166 HydrophobicContact CD1-CG 4.27Å; Y162-Q166 HydrophobicContact CD2-CG 4.26Å; Y162-Q166 HydrophobicContact CE1-CG 3.87Å; Y162-Q166 HydrophobicContact CE2-CG 3.86Å; Y162-Q166 HydrophobicContact CG-CG 4.45Å; Y162-Q166 VanDerWaalsContact O-CG 3.25Å; Y162-Q166 WeakPolarHBondContact O-CG 3.29Å; Y162-Q166 PolarHBondContact O-N 3.3Å; Y162-Q166 PolarHBondContact OH-NE2 2.92Å
163	E	94.6	Very high	93.5	Very high	77 Å²	77	74.2 Å²	74.2	36%	0.36	33%	0.331	S	S	.	.	H	α-helix	trans	-61.5	-44	179.4	-72.7	168.8	-171.8	0	0	112.7	Q159 L160 Q166 R167	Q159-E163 WeakPolarHBondContact CG-OE1 3.44Å; Q159-E163 PolarHBondContact NE2-OE1 3.43Å; Q159-E163 WeakPolarHBondContact O-CG 3.41Å; Q159-E163 PolarHBondContact O-N 2.83Å; L160-E163 PolarHBondContact O-N 3.4Å; E163-Q166 PolarHBondContact O-N 3.47Å; E163-R167 PolarHBondContact O-N 3.1Å
164	L	93.1	Very high	92.6	Very high	54 Å²	54	76.1 Å²	76.1	28%	0.283	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-43.2	177.3	-70	175	0	0	0	111.7	F91 L160 Y162 R167 E168	F91-L164 HydrophobicContact CE1-CD1 4.31Å; L160-L164 HydrophobicContact CD1-CD1 4.05Å; L160-L164 HydrophobicContact CD1-CG 4.1Å; L160-L164 HydrophobicContact CG-CD1 3.96Å; L160-L164 HydrophobicContact CG-CG 4.39Å; L160-L164 WeakPolarHBondContact O-CB 3.48Å; L160-L164 VanDerWaalsContact O-CG 3.26Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 2.93Å; Y162-L164 PolarHBondContact O-N 3.06Å; L164-R167 PolarHBondContact O-N 3.07Å; L164-E168 WeakPolarHBondContact O-CB 3.15Å; L164-E168 PolarHBondContact O-N 3.41Å
165	K	91.7	Very high	91.6	Very high	117 Å²	117	81.8 Å²	81.8	51%	0.509	37%	0.374	S	S	.	.	H	α-helix	trans	-64.2	-44.6	176.5	-81.2	-171.5	172.3	-170.3	0	112.4	I161 Y162 R167 E168 E169	I161-K165 HydrophobicContact CG2-CD 4.44Å; I161-K165 WeakPolarHBondContact O-CB 3.5Å; I161-K165 WeakPolarHBondContact O-CG 3.4Å; I161-K165 PolarHBondContact O-N 3.36Å; Y162-K165 PolarHBondContact O-N 3.46Å; K165-R167 VanDerWaalsContact C-N 3.3Å; K165-R167 PolarHBondContact O-N 3.39Å; K165-E168 PolarHBondContact O-N 2.97Å; K165-E169 WeakPolarHBondContact O-CG 3.25Å; K165-E169 PolarHBondContact O-N 3.21Å
166	Q	93.2	Very high	90.5	Very high	76 Å²	76	82 Å²	82	36%	0.355	38%	0.379	S	S	.	.	H	α-helix	trans	-60.1	-42.1	178.5	-71.7	-68.9	87.1	0	0	111.5	Y162 E163 E169 L170	Y162-Q166 HydrophobicContact CD1-CG 4.27Å; Y162-Q166 HydrophobicContact CD2-CG 4.26Å; Y162-Q166 HydrophobicContact CE1-CG 3.87Å; Y162-Q166 HydrophobicContact CE2-CG 3.86Å; Y162-Q166 HydrophobicContact CG-CG 4.45Å; Y162-Q166 VanDerWaalsContact O-CG 3.25Å; Y162-Q166 WeakPolarHBondContact O-CG 3.29Å; Y162-Q166 PolarHBondContact O-N 3.3Å; Y162-Q166 PolarHBondContact OH-NE2 2.92Å; E163-Q166 PolarHBondContact O-N 3.47Å; Q166-E169 PolarHBondContact O-N 3.37Å; Q166-L170 WeakPolarHBondContact O-CD1 3.49Å; Q166-L170 WeakPolarHBondContact O-CG 3.32Å; Q166-L170 PolarHBondContact O-N 3.32Å; Q166-L170 VanDerWaalsContact O-N 3.11Å
167	R	92.4	Very high	89.1	Confident	104 Å²	104	86.5 Å²	86.5	39%	0.392	40%	0.403	S	S	.	.	H	α-helix	trans	-64.1	-46.4	176.6	-169	-177.9	-58.6	159.6	6	111.6	E28 E163 L164 K165 E169 L170 E171	E28-R167 IonicContact OE1-CZ 3.72Å; E28-R167 IonicContact OE1-NH1 2.9Å; E28-R167 PolarHBondContact OE1-NH1 2.88Å; E28-R167 IonicContact OE1-NH2 3.62Å; E28-R167 IonicContact OE2-CZ 3.62Å; E28-R167 IonicContact OE2-NH1 3.53Å; E28-R167 IonicContact OE2-NH2 2.77Å; E28-R167 PolarHBondContact OE2-NH2 3.45Å; E163-R167 PolarHBondContact O-N 3.1Å; L164-R167 PolarHBondContact O-N 3.07Å; K165-R167 VanDerWaalsContact C-N 3.3Å; K165-R167 PolarHBondContact O-N 3.39Å; R167-E169 VanDerWaalsContact C-N 3.32Å; R167-E169 PolarHBondContact O-N 2.7Å; R167-L170 PolarHBondContact O-N 3Å; R167-E171 WeakPolarHBondContact O-CG 3.37Å; R167-E171 PolarHBondContact O-N 3.49Å
168	E	90.5	Very high	87.8	Confident	93 Å²	93	92.5 Å²	92.5	44%	0.435	43%	0.429	S	S	.	.	H	α-helix	trans	-61.4	-39.3	178.7	-167.3	-171.8	158.5	0	0	112.1	L164 K165 K172	L164-E168 WeakPolarHBondContact O-CB 3.15Å; L164-E168 PolarHBondContact O-N 3.41Å; K165-E168 PolarHBondContact O-N 2.97Å; E168-K172 HydrophobicContact CG-CD 4.28Å; E168-K172 WeakPolarHBondContact O-CB 3.35Å; E168-K172 WeakPolarHBondContact O-CD 3.44Å; E168-K172 VanDerWaalsContact O-CG 3.23Å; E168-K172 WeakPolarHBondContact O-CG 3.47Å; E168-K172 PolarHBondContact O-N 2.87Å; E168-K172 VanDerWaalsContact OE1-CE 3.3Å; E168-K172 WeakPolarHBondContact OE1-CE 3.48Å; E168-K172 IonicContact OE1-NZ 2.9Å; E168-K172 PolarHBondContact OE1-NZ 3.2Å
169	E	90.4	Very high	86.3	Confident	97 Å²	97	96.3 Å²	96.3	45%	0.453	45%	0.447	S	S	.	.	H	α-helix	trans	-67.6	-38.5	176.3	-74	-176.5	-170.9	0	0	113	K165 Q166 R167 K173	K165-E169 WeakPolarHBondContact O-CG 3.25Å; K165-E169 PolarHBondContact O-N 3.21Å; Q166-E169 PolarHBondContact O-N 3.37Å; R167-E169 VanDerWaalsContact C-N 3.32Å; R167-E169 PolarHBondContact O-N 2.7Å; E169-K173 WeakPolarHBondContact O-CG 3.38Å; E169-K173 PolarHBondContact O-N 2.92Å
170	L	89.1	Confident	84.5	Confident	119 Å²	119	95.6 Å²	95.6	62%	0.623	45%	0.452	S	S	*	.	H	α-helix	trans	-65.4	-45	175.3	-76	161.3	0	0	0	111.5	Q166 R167 K172 K173 A174	Q166-L170 WeakPolarHBondContact O-CD1 3.49Å; Q166-L170 WeakPolarHBondContact O-CG 3.32Å; Q166-L170 PolarHBondContact O-N 3.32Å; Q166-L170 VanDerWaalsContact O-N 3.11Å; R167-L170 PolarHBondContact O-N 3Å; L170-K172 VanDerWaalsContact C-N 3.35Å; L170-K172 PolarHBondContact O-N 3.48Å; L170-K173 PolarHBondContact O-N 2.91Å; L170-A174 WeakPolarHBondContact O-CB 3.34Å; L170-A174 PolarHBondContact O-N 3.32Å
171	E	88.7	Confident	82.7	Confident	120 Å²	120	100.8 Å²	100.8	56%	0.561	48%	0.476	S	S	*	.	H	α-helix	trans	-63.2	-41.7	176.8	-72.4	173.7	-172	0	0	111.4	R167 K173 A174 Q175	R167-E171 WeakPolarHBondContact O-CG 3.37Å; R167-E171 PolarHBondContact O-N 3.49Å; E171-K173 VanDerWaalsContact C-N 3.34Å; E171-K173 PolarHBondContact O-N 3.18Å; E171-A174 PolarHBondContact O-N 3.42Å; E171-Q175 WeakPolarHBondContact O-CB 3.34Å; E171-Q175 PolarHBondContact O-N 3.39Å
172	K	86.6	Confident	81	Confident	113 Å²	113	106 Å²	106	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-61.7	-38.6	175	-78.8	169.3	172.5	171.3	0	112.8	E168 L170 K176	E168-K172 HydrophobicContact CG-CD 4.28Å; E168-K172 WeakPolarHBondContact O-CB 3.35Å; E168-K172 WeakPolarHBondContact O-CD 3.44Å; E168-K172 VanDerWaalsContact O-CG 3.23Å; E168-K172 WeakPolarHBondContact O-CG 3.47Å; E168-K172 PolarHBondContact O-N 2.87Å; E168-K172 VanDerWaalsContact OE1-CE 3.3Å; E168-K172 WeakPolarHBondContact OE1-CE 3.48Å; E168-K172 IonicContact OE1-NZ 2.9Å; E168-K172 PolarHBondContact OE1-NZ 3.2Å; L170-K172 VanDerWaalsContact C-N 3.35Å; L170-K172 PolarHBondContact O-N 3.48Å; K172-K176 WeakPolarHBondContact O-CG 3.36Å; K172-K176 PolarHBondContact O-N 3.48Å; K172-K176 VanDerWaalsContact O-N 3.14Å
173	K	84.1	Confident	79.3	Confident	126 Å²	126	102.8 Å²	102.8	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-67.6	-48.9	175.1	-74.5	174	-178.1	174.7	0	111.1	E169 L170 E171 Q175 K176 D177	E169-K173 WeakPolarHBondContact O-CG 3.38Å; E169-K173 PolarHBondContact O-N 2.92Å; L170-K173 PolarHBondContact O-N 2.91Å; E171-K173 VanDerWaalsContact C-N 3.34Å; E171-K173 PolarHBondContact O-N 3.18Å; K173-Q175 VanDerWaalsContact C-N 3.26Å; K173-Q175 PolarHBondContact O-N 3.5Å; K173-K176 PolarHBondContact O-N 2.94Å; K173-K176 VanDerWaalsContact O-N 3.09Å; K173-D177 VanDerWaalsContact O-CG 3.27Å; K173-D177 PolarHBondContact O-N 3.13Å
174	A	80.5	Confident	77.6	Confident	44 Å²	44	104.7 Å²	104.7	36%	0.364	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-35.6	177.5	0	0	0	0	0	112.9	L170 E171 K178	L170-A174 WeakPolarHBondContact O-CB 3.34Å; L170-A174 PolarHBondContact O-N 3.32Å; E171-A174 PolarHBondContact O-N 3.42Å; A174-K178 WeakPolarHBondContact O-CB 3.5Å; A174-K178 VanDerWaalsContact O-CG 3.28Å; A174-K178 WeakPolarHBondContact O-CG 3.39Å; A174-K178 PolarHBondContact O-N 2.93Å; A174-K178 VanDerWaalsContact O-N 3.12Å
175	Q	76	Confident	75.9	Confident	119 Å²	119	110.3 Å²	110.3	56%	0.556	54%	0.536	S	S	*	.	H	α-helix	trans	-70.3	-38.6	176.3	-157.6	76.4	3.2	0	0	112.2	E171 K173 Q179	E171-Q175 WeakPolarHBondContact O-CB 3.34Å; E171-Q175 PolarHBondContact O-N 3.39Å; K173-Q175 VanDerWaalsContact C-N 3.26Å; K173-Q175 PolarHBondContact O-N 3.5Å; Q175-Q179 PolarHBondContact O-N 3.28Å; Q175-Q179 VanDerWaalsContact O-N 3.09Å
176	K	72.8	Confident	73.9	Confident	141 Å²	141	112.2 Å²	112.2	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-66.9	-42.2	174.7	-78.8	-178	177.2	-173.6	0	111.9	K172 K173 K178 Q179 C180	K172-K176 WeakPolarHBondContact O-CG 3.36Å; K172-K176 PolarHBondContact O-N 3.48Å; K172-K176 VanDerWaalsContact O-N 3.14Å; K173-K176 PolarHBondContact O-N 2.94Å; K173-K176 VanDerWaalsContact O-N 3.09Å; K176-K178 VanDerWaalsContact C-N 3.34Å; K176-K178 PolarHBondContact O-N 3.46Å; K176-Q179 PolarHBondContact O-N 2.88Å; K176-C180 PolarHBondContact O-N 3.33Å; K176-C180 PolarHBondContact O-SG 3.08Å; K176-C180 VanDerWaalsContact O-SG 3.42Å
177	D	69.4	Low	72.1	Confident	107 Å²	107	113.9 Å²	113.9	57%	0.572	56%	0.562	S	S	*	*	H	α-helix	trans	-64.3	-41.3	179.1	-64.4	-20.8	0	0	0	110.9	K173 Q179 C180 E181	K173-D177 VanDerWaalsContact O-CG 3.27Å; K173-D177 PolarHBondContact O-N 3.13Å; D177-Q179 PolarHBondContact O-N 3.33Å; D177-C180 PolarHBondContact O-N 2.87Å; D177-E181 WeakPolarHBondContact O-CB 3.41Å; D177-E181 PolarHBondContact O-N 3.34Å
178	K	70.2	Confident	70.2	Confident	126 Å²	126	114.5 Å²	114.5	55%	0.548	58%	0.58	S	S	.	*	H	α-helix	trans	-63	-38	172.9	-73.4	174.7	-177.4	179.8	0	113.3	A174 K176 Q182	A174-K178 WeakPolarHBondContact O-CB 3.5Å; A174-K178 VanDerWaalsContact O-CG 3.28Å; A174-K178 WeakPolarHBondContact O-CG 3.39Å; A174-K178 PolarHBondContact O-N 2.93Å; A174-K178 VanDerWaalsContact O-N 3.12Å; K176-K178 VanDerWaalsContact C-N 3.34Å; K176-K178 PolarHBondContact O-N 3.46Å; K178-Q182 WeakPolarHBondContact O-CB 3.5Å; K178-Q182 VanDerWaalsContact O-CG 3.27Å; K178-Q182 WeakPolarHBondContact O-CG 3.24Å; K178-Q182 PolarHBondContact O-N 2.65Å
179	Q	64.7	Low	68.5	Low	131 Å²	131	116.3 Å²	116.3	61%	0.612	60%	0.597	S	S	*	*	H	α-helix	trans	-69.5	-39.6	174.8	-86.5	-177.6	-3.7	0	0	112.4	Q175 K176 D177 A183	Q175-Q179 PolarHBondContact O-N 3.28Å; Q175-Q179 VanDerWaalsContact O-N 3.09Å; K176-Q179 PolarHBondContact O-N 2.88Å; D177-Q179 PolarHBondContact O-N 3.33Å; Q179-A183 WeakPolarHBondContact O-CB 3.45Å; Q179-A183 PolarHBondContact O-N 2.85Å; Q179-A183 VanDerWaalsContact O-N 3.07Å
180	C	59.3	Low	66.7	Low	80 Å²	80	116.8 Å²	116.8	54%	0.541	61%	0.611	S	S	.	*	H	α-helix	trans	-64.1	-44.6	174.6	-74.8	0	0	0	0	111.5	K176 D177 A183 V184	K176-C180 PolarHBondContact O-N 3.33Å; K176-C180 PolarHBondContact O-SG 3.08Å; K176-C180 VanDerWaalsContact O-SG 3.42Å; D177-C180 PolarHBondContact O-N 2.87Å; C180-A183 PolarHBondContact O-N 3.41Å; C180-V184 WeakPolarHBondContact O-CG2 3.35Å; C180-V184 PolarHBondContact O-N 2.98Å; C180-V184 VanDerWaalsContact O-N 3.13Å
181	E	59.4	Low	64.9	Low	111 Å²	111	118.9 Å²	118.9	52%	0.519	62%	0.618	S	S	.	*	H	α-helix	trans	-63.7	-44.1	178.7	-170.6	169.5	-158.3	0	0	111.4	D177 A183 V184 Y185	D177-E181 WeakPolarHBondContact O-CB 3.41Å; D177-E181 PolarHBondContact O-N 3.34Å; E181-A183 VanDerWaalsContact C-N 3.31Å; E181-A183 PolarHBondContact O-N 3.28Å; E181-V184 PolarHBondContact O-N 3.34Å; E181-Y185 HydrophobicContact CG-CD2 4.1Å; E181-Y185 HydrophobicContact CG-CE2 3.61Å; E181-Y185 WeakPolarHBondContact O-CD2 3.43Å; E181-Y185 PolarHBondContact O-N 2.84Å
182	Q	59.6	Low	62.9	Low	139 Å²	139	123.3 Å²	123.3	65%	0.65	64%	0.635	S	S	*	*	H	α-helix	trans	-62.2	-33.6	174.1	-75.1	177	-3.2	0	0	113.7	K178 Q186	K178-Q182 WeakPolarHBondContact O-CB 3.5Å; K178-Q182 VanDerWaalsContact O-CG 3.27Å; K178-Q182 WeakPolarHBondContact O-CG 3.24Å; K178-Q182 PolarHBondContact O-N 2.65Å; Q182-Q186 PolarHBondContact O-N 3.21Å
183	A	58.6	Low	61	Low	65 Å²	65	126.7 Å²	126.7	54%	0.537	65%	0.65	S	S	.	*	H	α-helix	trans	-72.3	-28.1	176.3	0	0	0	0	0	113.1	Q179 C180 E181	Q179-A183 WeakPolarHBondContact O-CB 3.45Å; Q179-A183 PolarHBondContact O-N 2.85Å; Q179-A183 VanDerWaalsContact O-N 3.07Å; C180-A183 PolarHBondContact O-N 3.41Å; E181-A183 VanDerWaalsContact C-N 3.31Å; E181-A183 PolarHBondContact O-N 3.28Å
184	V	59.1	Low	59.1	Low	117 Å²	117	129.6 Å²	129.6	71%	0.709	67%	0.665	S	S	*	*	H	α-helix	trans	-75.6	-31.4	177.3	173.3	0	0	0	0	112	C180 E181	C180-V184 WeakPolarHBondContact O-CG2 3.35Å; C180-V184 PolarHBondContact O-N 2.98Å; C180-V184 VanDerWaalsContact O-N 3.13Å; E181-V184 PolarHBondContact O-N 3.34Å
185	Y	57.8	Low	57.6	Low	171 Å²	171	130.7 Å²	130.7	67%	0.671	68%	0.681	S	S	*	*	S	Bend	trans	-83.6	-7.5	176.9	-68.7	-70.8	0	0	0	114.5	E181 V187	E181-Y185 HydrophobicContact CG-CD2 4.1Å; E181-Y185 HydrophobicContact CG-CE2 3.61Å; E181-Y185 WeakPolarHBondContact O-CD2 3.43Å; E181-Y185 PolarHBondContact O-N 2.84Å; Y185-V187 PolarHBondContact O-N 3.46Å; Y185-V187 VanDerWaalsContact O-N 3.07Å
186	Q	49.8	Very low	56.1	Low	157 Å²	157	130.9 Å²	130.9	73%	0.734	69%	0.69	S	S	*	*			trans	-78.5	87.8	167.7	-97.4	173.3	-7.6	0	0	110.1	Q182	Q182-Q186 PolarHBondContact O-N 3.21Å
187	V	54.6	Low	54.9	Low	111 Å²	111	134.8 Å²	134.8	67%	0.673	70%	0.702	S	S	*	*			trans	-56.8	128.1	166.5	-176.3	0	0	0	0	108.7	Y185 T189	Y185-V187 PolarHBondContact O-N 3.46Å; Y185-V187 VanDerWaalsContact O-N 3.07Å; V187-T189 PolarHBondContact O-N 3.47Å
188	P	53.7	Low	54	Low	118 Å²	118	136.7 Å²	136.7	77%	0.766	71%	0.713	S	S	*	*			trans	-60.4	100.5	169.9	-20	31.1	0	0	0	109.6	S190	P188-S190 VanDerWaalsContact C-N 3.32Å; P188-S190 PolarHBondContact O-N 2.83Å; P188-S190 VanDerWaalsContact O-N 3.09Å
189	T	55.1	Low	53.4	Low	130 Å²	130	136.4 Å²	136.4	80%	0.798	72%	0.721	S	S	*	*			trans	-84.1	78.9	175	39.6	0	0	0	0	109.2	V187	V187-T189 PolarHBondContact O-N 3.47Å
190	S	52	Low	53	Low	107 Å²	107	135.9 Å²	135.9	75%	0.748	73%	0.729	S	S	*	*			trans	-160.9	114	165	-79	0	0	0	0	105.6	P188	P188-S190 VanDerWaalsContact C-N 3.32Å; P188-S190 PolarHBondContact O-N 2.83Å; P188-S190 VanDerWaalsContact O-N 3.09Å
191	Q	50.5	Low	52.6	Low	163 Å²	163	141.2 Å²	141.2	76%	0.762	74%	0.743	S	S	*	*			cis	-151.4	136.9	30.6	-65.3	170.2	-22.8	0	0	108.6	K193	Q191-K193 PolarHBondContact O-N 3.01Å
192	K	46.7	Very low	52.6	Low	214 Å²	214	141.5 Å²	141.5	93%	0.93	76%	0.757	S	S	*	*			trans	-63.5	111.4	157	-84.1	178.4	173.4	177.4	0	107.2
193	K	47.2	Very low	52.3	Low	184 Å²	184	143.3 Å²	143.3	80%	0.8	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-91.2	120.2	156.1	-81.5	-170.9	176.8	-178.3	0	107.5	Q191	Q191-K193 PolarHBondContact O-N 3.01Å
194	E	43.3	Very low	52.5	Low	187 Å²	187	149.5 Å²	149.5	87%	0.874	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-54.8	133.8	174.3	-68.6	177.8	146.8	0	0	110.2
195	G	49.1	Very low	52.1	Low	66 Å²	66	151.2 Å²	151.2	68%	0.68	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.1	127.2	174.1	0	0	0	0	0	110.5
196	V	45.8	Very low	51.8	Low	124 Å²	124	150.1 Å²	150.1	75%	0.752	81%	0.812	S	S	*	*			trans	-120.2	107	155.1	177	0	0	0	0	105.4
197	Y	47.2	Very low	51.9	Low	222 Å²	222	149.7 Å²	149.7	87%	0.871	82%	0.816	S	S	*	*			trans	-84	107.7	167.6	-72.1	-85.9	0	0	0	107.4
198	D	50.4	Low	51.8	Low	148 Å²	148	152 Å²	152	79%	0.791	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-83.4	119.6	166.4	-109.3	-46.8	0	0	0	109.1
199	V	58.2	Low	51.7	Low	120 Å²	120	154.1 Å²	154.1	73%	0.727	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.6	120.5	174.8	178.2	0	0	0	0	108	K201	V199-K201 PolarHBondContact O-N 3.03Å; V199-K201 VanDerWaalsContact O-N 3.16Å
200	P	56.3	Low	51.4	Low	119 Å²	119	155.7 Å²	155.7	77%	0.773	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-68.4	116.1	174.6	-15.9	29.9	0	0	0	109.8	S202	P200-S202 PolarHBondContact O-N 2.93Å
201	K	49.3	Very low	51.4	Low	192 Å²	192	159.2 Å²	159.2	84%	0.835	84%	0.836	S	S	*	*			trans	-65.5	112.7	167.6	-77.1	-178.5	178.7	175.3	0	108.9	V199	V199-K201 PolarHBondContact O-N 3.03Å; V199-K201 VanDerWaalsContact O-N 3.16Å
202	S	60.3	Low	51.5	Low	117 Å²	117	158.9 Å²	158.9	82%	0.818	84%	0.842	S	S	*	*			trans	-71.1	128.9	157.3	41.9	0	0	0	0	108.9	P200	P200-S202 PolarHBondContact O-N 2.93Å
203	Q	52.6	Low	51.9	Low	178 Å²	178	154.3 Å²	154.3	83%	0.832	84%	0.835	S	S	*	*			trans	-141.8	157.2	166.8	-97.8	-160.9	-11.6	0	0	110
204	P	62.9	Low	52.3	Low	195 Å²	195	151.6 Å²	151.6	100%	1.266	84%	0.838	S	S	*	*				-85.3	0	-125.2	31.7	-38.1	0	0	0	116.1

Retrieved 204 of 204 residues in 94.5 ms (Link to these results)

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