A0A077Z772_TRITR Loading...

Large ribosomal subunit protein uL16m

AlphaFold DB , UniProt , Accession A0A077Z772, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 219 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	59.1	Low	76.4	Confident	242 Å²	242	159 Å²	159	100%	1.192	78%	0.784	S	S	*	*				0	125.4	0	-73.6	-175.3	170.7	0	0	108.2	M3	M1-M3 PolarHBondContact O-N 3Å
2	K	61.8	Low	77.2	Confident	205 Å²	205	157.3 Å²	157.3	89%	0.891	79%	0.793	S	S	*	*			trans	-75.9	113.2	174.8	-154.4	174.6	-174	-179.1	0	106.6	L4	K2-L4 PolarHBondContact O-N 3.08Å; K2-L4 VanDerWaalsContact O-N 3.14Å
3	M	71.2	Confident	78.1	Confident	179 Å²	179	147.3 Å²	147.3	88%	0.882	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-62.4	117.8	176.4	-79.2	-166.3	145.1	0	0	108	M1 E5	M1-M3 PolarHBondContact O-N 3Å; M3-E5 PolarHBondContact O-N 3.42Å
4	L	78.2	Confident	79.1	Confident	165 Å²	165	142.8 Å²	142.8	86%	0.864	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-70.9	123.4	173.2	-69	167.7	0	0	0	107.4	K2	K2-L4 PolarHBondContact O-N 3.08Å; K2-L4 VanDerWaalsContact O-N 3.14Å
5	E	82	Confident	79.9	Confident	188 Å²	188	138.7 Å²	138.7	88%	0.879	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-63.8	142.3	170.4	-66.6	-179	176.2	0	0	109	M3	M3-E5 PolarHBondContact O-N 3.42Å
6	R	80.6	Confident	80.6	Confident	238 Å²	238	131.3 Å²	131.3	90%	0.898	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-60.6	144.2	176.4	-79.4	-171.5	-73	-153.2	-2.4	109.6	L8	R6-L8 PolarHBondContact O-N 3.14Å
7	P	81.8	Confident	81	Confident	107 Å²	107	131.5 Å²	131.5	70%	0.695	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-57	142.9	173.9	26.3	-34	0	0	0	109.5	E9	P7-E9 PolarHBondContact O-N 3.34Å; P7-E9 VanDerWaalsContact O-N 3.08Å
8	L	82	Confident	81.2	Confident	115 Å²	115	127.7 Å²	127.7	60%	0.602	67%	0.674	S	S	*	*			trans	-68.1	109	179.5	-166.5	80.5	0	0	0	109.1	R6 F10 T145	R6-L8 PolarHBondContact O-N 3.14Å; L8-F10 HydrophobicContact CD2-CE1 3.93Å; L8-F10 HydrophobicContact CD2-CZ 4.04Å; L8-T145 HydrophobicContact CD2-CG2 3.5Å; L8-T145 VanDerWaalsContact CD2-CG2 3.5Å
9	E	81.5	Confident	81.4	Confident	177 Å²	177	130.7 Å²	130.7	83%	0.827	68%	0.684	S	S	*	*			trans	-85.8	126.5	173.7	-67.4	-173	172.5	0	0	109.8	P7	P7-E9 PolarHBondContact O-N 3.34Å; P7-E9 VanDerWaalsContact O-N 3.08Å
10	F	81.2	Confident	81.5	Confident	81 Å²	81	130.4 Å²	130.4	36%	0.355	68%	0.679	S	S	.	*			trans	-84.1	121.1	174.5	-59.7	-81.4	0	0	0	108.6	L8 H143 T145	L8-F10 HydrophobicContact CD2-CE1 3.93Å; L8-F10 HydrophobicContact CD2-CZ 4.04Å; F10-H143 HydrophobicContact CD1-CB 4.15Å; F10-H143 HydrophobicContact CD2-CB 4.03Å; F10-H143 AromaticContact CD2-CD2 3.53Å; F10-H143 HydrophobicContact CE1-CB 4.17Å; F10-H143 HydrophobicContact CE2-CB 4.04Å; F10-H143 HydrophobicContact CG-CB 4.07Å; F10-H143 AromaticContact CG-CD2 3.68Å; F10-H143 HydrophobicContact CZ-CB 4.11Å; F10-T145 HydrophobicContact CE1-CG2 4.39Å; F10-T145 HydrophobicContact CZ-CG2 4.23Å
11	G	80.8	Confident	81.9	Confident	52 Å²	52	129.1 Å²	129.1	54%	0.536	67%	0.665	S	S	.	*			trans	-64.6	-177.1	174.6	0	0	0	0	0	113	V13	G11-V13 WeakPolarHBondContact O-CG2 3.4Å; G11-V13 PolarHBondContact O-N 3.22Å
12	P	86	Confident	83.6	Confident	138 Å²	138	122.1 Å²	122.1	90%	0.896	63%	0.626	S	S	*	*			trans	-60.6	111.7	179.1	25.3	-33.3	0	0	0	110.6
13	V	89.4	Confident	85.2	Confident	28 Å²	28	112.4 Å²	112.4	17%	0.17	58%	0.584	C	S	.	*			trans	-89.9	128.1	179.6	-176.8	0	0	0	0	109.9	G11 F15 F96	G11-V13 WeakPolarHBondContact O-CG2 3.4Å; G11-V13 PolarHBondContact O-N 3.22Å; V13-F15 HydrophobicContact CB-CD2 4.21Å; V13-F15 HydrophobicContact CB-CE2 3.73Å; V13-F15 HydrophobicContact CB-CZ 4.26Å; V13-F15 HydrophobicContact CG1-CD2 3.96Å; V13-F15 HydrophobicContact CG1-CE1 4.38Å; V13-F15 HydrophobicContact CG1-CE2 3.67Å; V13-F15 HydrophobicContact CG1-CG 4.44Å; V13-F15 HydrophobicContact CG1-CZ 3.89Å; V13-F96 HydrophobicContact CG1-CE1 4.16Å
14	I	91.5	Very high	86.4	Confident	84 Å²	84	105.9 Å²	105.9	43%	0.431	56%	0.555	S	S	.	*			trans	-87.2	109.6	170.4	-55.5	171.6	0	0	0	107.3	H62 R63 F96	I14-H62 PolarHBondContact O-CD2 2.89Å; I14-H62 VanDerWaalsContact O-CD2 3.27Å; I14-R63 HydrophobicContact CD1-CG 4.45Å; I14-F96 WeakPolarHBondContact O-CZ 3.15Å
15	F	91.1	Very high	87.2	Confident	81 Å²	81	102.6 Å²	102.6	36%	0.355	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-86.1	150.5	174.4	-74.2	-88.1	0	0	0	111.1	V13 F96	V13-F15 HydrophobicContact CB-CD2 4.21Å; V13-F15 HydrophobicContact CB-CE2 3.73Å; V13-F15 HydrophobicContact CB-CZ 4.26Å; V13-F15 HydrophobicContact CG1-CD2 3.96Å; V13-F15 HydrophobicContact CG1-CE1 4.38Å; V13-F15 HydrophobicContact CG1-CE2 3.67Å; V13-F15 HydrophobicContact CG1-CG 4.44Å; V13-F15 HydrophobicContact CG1-CZ 3.89Å; F15-F96 AromaticContact CD1-CD1 3.4Å; F15-F96 HydrophobicContact CD1-CD1 3.4Å; F15-F96 AromaticContact CD1-CE1 3.64Å; F15-F96 HydrophobicContact CD1-CE1 3.64Å; F15-F96 HydrophobicContact CD1-CG 4.49Å; F15-F96 AromaticContact CE1-CD1 3.7Å; F15-F96 HydrophobicContact CE1-CD1 3.7Å; F15-F96 HydrophobicContact CE1-CE1 4.05Å; F15-F96 HydrophobicContact CG-CD1 4.35Å; F15-F96 HydrophobicContact CG-CE1 4.2Å
16	P	91.3	Very high	87.9	Confident	20 Å²	20	94.4 Å²	94.4	13%	0.13	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-61.9	153	172.3	26.2	-35.7	0	0	0	111.7	G18 H62 F96 I98	P16-G18 PolarHBondContact O-N 3.39Å; P16-H62 VanDerWaalsContact CA-NE2 3.34Å; P16-H62 WeakPolarHBondContact CA-NE2 3.48Å; P16-F96 HydrophobicContact CG-CB 4.43Å; P16-F96 HydrophobicContact CG-CD2 3.96Å; P16-F96 HydrophobicContact CG-CE2 4.35Å; P16-F96 HydrophobicContact CG-CG 4.06Å; P16-I98 HydrophobicContact CB-CD1 3.5Å; P16-I98 HydrophobicContact CB-CG1 4.41Å; P16-I98 HydrophobicContact CG-CD1 3.68Å; P16-I98 HydrophobicContact CG-CG1 4.35Å
17	P	87.4	Confident	88.7	Confident	136 Å²	136	85.9 Å²	85.9	88%	0.883	48%	0.482	S	S	*	.	S	Bend	trans	-65	120.7	167.9	27.6	-31.8	0	0	0	109.5
18	G	85.3	Confident	89.4	Confident	63 Å²	63	87.3 Å²	87.3	65%	0.649	48%	0.477	S	S	*	.	S	Bend	trans	115.9	173	177.5	0	0	0	0	0	114.2	P16	P16-G18 PolarHBondContact O-N 3.39Å
19	E	84.2	Confident	90	Very high	184 Å²	184	83.6 Å²	83.6	86%	0.86	46%	0.463	S	S	*	.	S	Bend	trans	-88.1	-11.8	-178.4	-67	-180	175	0	0	113.1	R21	E19-R21 PolarHBondContact O-N 2.94Å
20	Q	83.8	Confident	90.6	Very high	125 Å²	125	77 Å²	77	58%	0.584	44%	0.435	S	S	*	.			trans	-73.9	104.8	-174.3	-173.4	153.7	39.4	0	0	111.6	Y22	Q20-Y22 WeakPolarHBondContact CG-O 3.39Å
21	R	90.2	Very high	91.1	Very high	103 Å²	103	80.4 Å²	80.4	39%	0.389	46%	0.456	S	S	.	.			trans	-95.4	-27.5	178.8	-65.8	-174.9	-170.2	-170.6	1.2	113.6	E19 L91 D93 A95 F96 A97	E19-R21 PolarHBondContact O-N 2.94Å; R21-L91 WeakPolarHBondContact O-CD2 3.15Å; R21-D93 WeakPolarHBondContact CD-O 3.48Å; R21-D93 PolarHBondContact NH1-O 3.44Å; R21-A95 WeakPolarHBondContact CB-O 3.41Å; R21-F96 HydrophobicContact CB-CB 4.12Å; R21-F96 HydrophobicContact CG-CB 4.26Å; R21-F96 CarbonylContact O-C 3.42Å; R21-F96 WeakPolarHBondContact O-CA 3.42Å; R21-A97 PolarHBondContact O-N 2.68Å
22	Y	94.8	Very high	91.7	Very high	95 Å²	95	81 Å²	81	37%	0.373	44%	0.444	S	S	.	.	S	Bend	trans	-95.9	156	-178.4	-51.1	-84.5	0	0	0	112.1	Q20 P24 L91 D93	Q20-Y22 WeakPolarHBondContact CG-O 3.39Å; Y22-P24 VanDerWaalsContact O-CD 3.29Å; Y22-P24 WeakPolarHBondContact O-CD 2.96Å; Y22-L91 HydrophobicContact CD1-CB 4.18Å; Y22-L91 HydrophobicContact CD1-CD2 3.57Å; Y22-L91 HydrophobicContact CD1-CG 4.43Å; Y22-L91 HydrophobicContact CE1-CB 4.17Å; Y22-L91 HydrophobicContact CE1-CD2 3.99Å; Y22-L91 HydrophobicContact CE1-CG 4.49Å; Y22-L91 HydrophobicContact CG-CD2 4.28Å; Y22-D93 PolarHBondContact OH-OD1 2.87Å
23	L	95.8	Very high	92	Very high	2 Å²	2	77.2 Å²	77.2	1%	0.01	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-65.4	119.7	175	-67	171.3	0	0	0	110	I83 R84 V87 N88 A97 I98 W99 V138	L23-I83 HydrophobicContact CD1-CG2 4.21Å; L23-R84 HydrophobicContact CB-CG 4.01Å; L23-R84 WeakPolarHBondContact O-CD 3.3Å; L23-R84 WeakPolarHBondContact O-CG 3.1Å; L23-V87 HydrophobicContact CD1-CB 3.94Å; L23-V87 HydrophobicContact CD1-CG1 3.95Å; L23-V87 HydrophobicContact CD1-CG2 4.35Å; L23-N88 VanDerWaalsContact CB-OD1 3.32Å; L23-N88 WeakPolarHBondContact CB-OD1 3.23Å; L23-N88 PolarHBondContact N-OD1 3.13Å; L23-N88 PolarHBondContact O-ND2 3.31Å; L23-A97 HydrophobicContact CD1-CB 4.3Å; L23-A97 HydrophobicContact CD2-CB 4Å; L23-A97 WeakPolarHBondContact CD2-O 3.49Å; L23-A97 HydrophobicContact CG-CB 3.75Å; L23-I98 VanDerWaalsContact CD2-C 3.44Å; L23-W99 HydrophobicContact CB-CZ2 4.16Å; L23-W99 HydrophobicContact CD1-CH2 4.16Å; L23-W99 HydrophobicContact CD1-CZ2 3.91Å; L23-W99 HydrophobicContact CD2-CD2 3.8Å; L23-W99 HydrophobicContact CD2-CE3 4.37Å; L23-W99 HydrophobicContact CD2-CG 3.94Å; L23-W99 HydrophobicContact CD2-CZ2 4.32Å; L23-W99 HydrophobicContact CG-CZ2 4.37Å; L23-V138 HydrophobicContact CD1-CG1 4.37Å; L23-V138 HydrophobicContact CD2-CG1 4.27Å
24	P	95.3	Very high	92	Very high	41 Å²	41	81.3 Å²	81.3	27%	0.266	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-67.1	155.9	176.3	23.9	-31.1	0	0	0	111.6	Y22 W99	Y22-P24 VanDerWaalsContact O-CD 3.29Å; Y22-P24 WeakPolarHBondContact O-CD 2.96Å; P24-W99 PolarHBondContact O-NE1 3.09Å; P24-W99 VanDerWaalsContact O-NE1 3.09Å
25	P	96.1	Very high	92.1	Very high	96 Å²	96	81.5 Å²	81.5	62%	0.623	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-62.5	136.9	167.6	28.7	-33.6	0	0	0	110
26	V	96.6	Very high	92.2	Very high	17 Å²	17	84.5 Å²	84.5	10%	0.103	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-99.3	129.7	-177.4	179.9	0	0	0	0	109.1	H77 F80 W99 P103	V26-H77 PolarHBondContact O-CE1 3.4Å; V26-H77 PolarHBondContact O-ND1 3.3Å; V26-F80 HydrophobicContact CB-CB 4.15Å; V26-F80 HydrophobicContact CB-CD1 4.46Å; V26-F80 HydrophobicContact CB-CG 4.31Å; V26-F80 HydrophobicContact CG1-CD1 4.35Å; V26-F80 HydrophobicContact CG1-CG 4.24Å; V26-F80 HydrophobicContact CG2-CB 4.09Å; V26-F80 HydrophobicContact CG2-CD1 3.89Å; V26-F80 HydrophobicContact CG2-CG 4.18Å; V26-W99 HydrophobicContact CG2-CZ2 4.28Å; V26-P103 HydrophobicContact CG1-CB 3.65Å
27	P	96.6	Very high	92.1	Very high	59 Å²	59	92 Å²	92	38%	0.383	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-62.9	146.6	178.6	27.4	-35.4	0	0	0	111.4	P103	P27-P103 HydrophobicContact CG-CB 3.9Å
28	K	96.2	Very high	92.3	Very high	137 Å²	137	89.5 Å²	89.5	60%	0.596	48%	0.477	S	S	*	.	S	Bend	trans	-75.3	-27.5	-178.9	-175.7	177.8	177.1	-175.2	0	113.1	H77	K28-H77 HydrophobicContact CB-CB 4.43Å; K28-H77 HydrophobicContact CG-CB 4.11Å
29	A	94.3	Very high	92.4	Very high	37 Å²	37	93.1 Å²	93.1	31%	0.306	48%	0.477	S	S	.	.	S	Bend	trans	-135.7	151.9	-180	0	0	0	0	0	108.8	Y127	A29-Y127 HydrophobicContact CB-CD2 3.63Å; A29-Y127 HydrophobicContact CB-CE2 3.58Å
30	P	94.5	Very high	92.6	Very high	38 Å²	38	89.7 Å²	89.7	25%	0.247	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-63.5	150	172.3	28.3	-33.6	0	0	0	110.6	F32 Y127	P30-F32 HydrophobicContact CB-CZ 4.46Å; P30-F32 HydrophobicContact CG-CE1 4.17Å; P30-F32 HydrophobicContact CG-CE2 3.91Å; P30-F32 HydrophobicContact CG-CZ 3.54Å; P30-F32 WeakPolarHBondContact O-CD2 3.26Å; P30-F32 WeakPolarHBondContact O-CE2 3.28Å; P30-Y127 HydrophobicContact CG-CD1 4.1Å; P30-Y127 HydrophobicContact CG-CE1 3.82Å
31	I	92.8	Very high	92.9	Very high	152 Å²	152	93 Å²	93	78%	0.779	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-84.8	122.4	174.8	-58.1	170.8	0	0	0	107.1
32	F	91.9	Very high	92.9	Very high	66 Å²	66	95.7 Å²	95.7	29%	0.289	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-96.9	126.5	177.7	-60.7	-79.1	0	0	0	109.8	P30 P34 E38 E40 Y127	P30-F32 HydrophobicContact CB-CZ 4.46Å; P30-F32 HydrophobicContact CG-CE1 4.17Å; P30-F32 HydrophobicContact CG-CE2 3.91Å; P30-F32 HydrophobicContact CG-CZ 3.54Å; P30-F32 WeakPolarHBondContact O-CD2 3.26Å; P30-F32 WeakPolarHBondContact O-CE2 3.28Å; F32-P34 VanDerWaalsContact O-CD 3.29Å; F32-P34 WeakPolarHBondContact O-CD 3.35Å; F32-E38 HydrophobicContact CB-CB 4.12Å; F32-E38 HydrophobicContact CD1-CB 4.22Å; F32-E40 HydrophobicContact CD2-CG 4.02Å; F32-E40 HydrophobicContact CE1-CG 4.49Å; F32-E40 HydrophobicContact CE2-CG 3.43Å; F32-E40 VanDerWaalsContact CE2-CG 3.43Å; F32-E40 HydrophobicContact CZ-CB 4.38Å; F32-E40 HydrophobicContact CZ-CG 3.68Å; F32-Y127 HydrophobicContact CZ-CE1 4.49Å; F32-Y127 WeakPolarHBondContact CZ-OH 3.5Å
33	D	92.4	Very high	92.7	Very high	57 Å²	57	92.3 Å²	92.3	31%	0.305	47%	0.472	S	S	.	.			trans	-81	112.4	178.8	-174.8	-9.9	0	0	0	111	A35 K36 K37 E38	D33-A35 VanDerWaalsContact C-N 3.26Å; D33-A35 PolarHBondContact O-N 3.49Å; D33-A35 VanDerWaalsContact OD1-CB 3.31Å; D33-A35 WeakPolarHBondContact OD1-CB 3.15Å; D33-A35 PolarHBondContact OD1-N 3.48Å; D33-K36 HydrophobicContact CB-CB 4.22Å; D33-K36 HydrophobicContact CB-CD 4.17Å; D33-K36 HydrophobicContact CB-CG 4.29Å; D33-K36 PolarHBondContact O-N 3.31Å; D33-K36 WeakPolarHBondContact OD2-CD 3.37Å; D33-K36 WeakPolarHBondContact OD2-CE 3.33Å; D33-K36 IonicContact OD2-NZ 3.47Å; D33-K37 PolarHBondContact O-N 2.87Å; D33-E38 PolarHBondContact N-OE2 2.84Å; D33-E38 PolarHBondContact O-N 2.82Å; D33-E38 VanDerWaalsContact O-N 3.12Å
34	P	90.5	Very high	92.5	Very high	114 Å²	114	97.4 Å²	97.4	74%	0.74	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-28.4	179.8	28	-34.4	0	0	0	112.4	F32 K36 K37	F32-P34 VanDerWaalsContact O-CD 3.29Å; F32-P34 WeakPolarHBondContact O-CD 3.35Å; P34-K36 VanDerWaalsContact C-N 3.29Å; P34-K36 PolarHBondContact O-N 3.04Å; P34-K37 PolarHBondContact O-N 3.4Å; P34-K37 VanDerWaalsContact O-N 3.08Å
35	A	94	Very high	92.4	Very high	89 Å²	89	103 Å²	103	74%	0.736	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-34.2	178.9	0	0	0	0	0	111.4	D33 K37	D33-A35 VanDerWaalsContact C-N 3.26Å; D33-A35 PolarHBondContact O-N 3.49Å; D33-A35 VanDerWaalsContact OD1-CB 3.31Å; D33-A35 WeakPolarHBondContact OD1-CB 3.15Å; D33-A35 PolarHBondContact OD1-N 3.48Å; A35-K37 VanDerWaalsContact C-N 3.27Å; A35-K37 PolarHBondContact O-N 3.49Å
36	K	91.9	Very high	92.3	Very high	144 Å²	144	103.9 Å²	103.9	63%	0.626	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-0.3	174.4	-66.6	177.9	-170.4	166.9	0	113.7	D33 P34 E38	D33-K36 HydrophobicContact CB-CB 4.22Å; D33-K36 HydrophobicContact CB-CD 4.17Å; D33-K36 HydrophobicContact CB-CG 4.29Å; D33-K36 PolarHBondContact O-N 3.31Å; D33-K36 WeakPolarHBondContact OD2-CD 3.37Å; D33-K36 WeakPolarHBondContact OD2-CE 3.33Å; D33-K36 IonicContact OD2-NZ 3.47Å; P34-K36 VanDerWaalsContact C-N 3.29Å; P34-K36 PolarHBondContact O-N 3.04Å; K36-E38 HydrophobicContact CB-CG 3.94Å; K36-E38 PolarHBondContact O-N 3.43Å
37	K	89.4	Confident	92.2	Very high	176 Å²	176	108 Å²	108	77%	0.765	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	33.8	-172.3	-54.7	177.3	-179.4	176.7	0	112.1	D33 P34 A35	D33-K37 PolarHBondContact O-N 2.87Å; P34-K37 PolarHBondContact O-N 3.4Å; P34-K37 VanDerWaalsContact O-N 3.08Å; A35-K37 VanDerWaalsContact C-N 3.27Å; A35-K37 PolarHBondContact O-N 3.49Å
38	E	90.9	Very high	92.1	Very high	85 Å²	85	108.3 Å²	108.3	40%	0.397	53%	0.533	S	S	.	.			trans	-69.3	133.2	172.8	-71.2	175.3	179.3	0	0	109.1	F32 D33 K36	F32-E38 HydrophobicContact CB-CB 4.12Å; F32-E38 HydrophobicContact CD1-CB 4.22Å; D33-E38 PolarHBondContact N-OE2 2.84Å; D33-E38 PolarHBondContact O-N 2.82Å; D33-E38 VanDerWaalsContact O-N 3.12Å; K36-E38 HydrophobicContact CB-CG 3.94Å; K36-E38 PolarHBondContact O-N 3.43Å
39	Q	88	Confident	92.1	Very high	138 Å²	138	103 Å²	103	65%	0.645	51%	0.51	S	S	*	.			trans	-135.6	154.1	-177.9	-68.7	-177	-20.3	0	0	109.6	R41	Q39-R41 PolarHBondContact O-N 3.38Å; Q39-R41 VanDerWaalsContact O-N 3.1Å
40	E	89	Confident	92.2	Very high	112 Å²	112	103.1 Å²	103.1	52%	0.523	51%	0.505	S	S	.	.			trans	-59.5	112.8	171.7	-65.5	-157.6	148.6	0	0	110.7	F32 I124 Y127	F32-E40 HydrophobicContact CD2-CG 4.02Å; F32-E40 HydrophobicContact CE1-CG 4.49Å; F32-E40 HydrophobicContact CE2-CG 3.43Å; F32-E40 VanDerWaalsContact CE2-CG 3.43Å; F32-E40 HydrophobicContact CZ-CB 4.38Å; F32-E40 HydrophobicContact CZ-CG 3.68Å; E40-I124 HydrophobicContact CB-CD1 3.95Å; E40-Y127 VanDerWaalsContact CD-OH 3.26Å; E40-Y127 PolarHBondContact OE1-OH 2.91Å
41	R	89.7	Confident	92.2	Very high	195 Å²	195	104.3 Å²	104.3	74%	0.736	51%	0.505	S	S	*	.			trans	-113.2	135.2	176.1	-68.1	-177.4	-177.6	-171.1	1.9	109.9	Q39 P107	Q39-R41 PolarHBondContact O-N 3.38Å; Q39-R41 VanDerWaalsContact O-N 3.1Å; R41-P107 WeakPolarHBondContact O-CG 3.36Å
42	Y	90.3	Very high	92.4	Very high	160 Å²	160	97.3 Å²	97.3	63%	0.627	47%	0.47	S	S	*	.			trans	-69.2	139.9	171.8	56.3	-101.2	0	0	0	110.4	K121	Y42-K121 HydrophobicContact CD2-CD 3.58Å; Y42-K121 HydrophobicContact CE2-CD 4.28Å; Y42-K121 HydrophobicContact CG-CD 3.71Å; Y42-K121 HydrophobicContact CG-CG 4.47Å
43	A	89.7	Confident	92.6	Very high	24 Å²	24	95.2 Å²	95.2	20%	0.198	46%	0.463	C	S	.	.			trans	-112.6	149.2	174.1	0	0	0	0	0	110.7	L106 P107 K121	A43-L106 HydrophobicContact CB-CD1 4.21Å; A43-P107 HydrophobicContact CB-CG 3.74Å; A43-K121 PolarHBondContact O-NZ 3.06Å
44	T	92.4	Very high	92.8	Very high	109 Å²	109	93.9 Å²	93.9	67%	0.669	46%	0.455	S	S	*	.			trans	-54.7	165.8	163.9	30.6	0	0	0	0	110.7	R46	T44-R46 PolarHBondContact O-N 3.2Å
45	K	92.2	Very high	93.1	Very high	158 Å²	158	94.9 Å²	94.9	69%	0.687	45%	0.453	S	S	*	.			trans	-61.3	-20.1	-173.8	-68.6	-177	-179.9	178.8	0	113.9	L47 R108	K45-L47 VanDerWaalsContact C-N 3.25Å; K45-L47 HydrophobicContact CB-CD2 4.38Å; K45-L47 HydrophobicContact CB-CG 4.15Å; K45-L47 PolarHBondContact O-N 2.93Å; K45-R108 PolarHBondContact O-NH1 3.41Å; K45-R108 PolarHBondContact O-NH2 3.47Å; K45-R108 VanDerWaalsContact O-NH2 3.09Å
46	R	94.4	Very high	93.1	Very high	115 Å²	115	95.9 Å²	95.9	43%	0.434	45%	0.45	S	S	.	.			trans	45.5	46.6	177.3	-67.5	179.4	69.5	161.2	4.8	112.9	T44 I48 E49 L106	T44-R46 PolarHBondContact O-N 3.2Å; R46-I48 PolarHBondContact O-N 3.39Å; R46-I48 VanDerWaalsContact O-N 3.14Å; R46-E49 HydrophobicContact CB-CG 4.09Å; R46-E49 IonicContact CZ-OE1 3.59Å; R46-E49 IonicContact NE-OE1 3.41Å; R46-E49 PolarHBondContact NE-OE1 2.93Å; R46-E49 IonicContact NE-OE2 2.66Å; R46-E49 IonicContact NH1-OE1 2.83Å; R46-E49 IonicContact NH2-OE1 2.7Å; R46-E49 PolarHBondContact NH2-OE1 3.43Å; R46-E49 WeakPolarHBondContact O-CB 3.39Å; R46-E49 WeakPolarHBondContact O-CG 3.38Å; R46-E49 PolarHBondContact O-N 3.45Å; R46-E49 VanDerWaalsContact O-N 3.1Å; R46-L106 HydrophobicContact CB-CD1 4.25Å; R46-L106 HydrophobicContact CG-CD1 4.41Å
47	L	95.3	Very high	93.4	Very high	102 Å²	102	92.2 Å²	92.2	53%	0.534	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-63.6	-19.3	-178.9	-63.8	178.2	0	0	0	113.3	K45 E49 I50 F74	K45-L47 VanDerWaalsContact C-N 3.25Å; K45-L47 HydrophobicContact CB-CD2 4.38Å; K45-L47 HydrophobicContact CB-CG 4.15Å; K45-L47 PolarHBondContact O-N 2.93Å; L47-E49 PolarHBondContact O-N 3.43Å; L47-I50 WeakPolarHBondContact O-CG1 3.43Å; L47-I50 PolarHBondContact O-N 3.31Å; L47-F74 HydrophobicContact CD2-CE2 4.07Å; L47-F74 HydrophobicContact CD2-CZ 4.08Å
48	I	94.6	Very high	93.7	Very high	67 Å²	67	86.2 Å²	86.2	34%	0.344	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-63.2	-18.4	174.5	-169.1	54.9	0	0	0	113.3	R46 I50 R51 R132 Y210	R46-I48 PolarHBondContact O-N 3.39Å; R46-I48 VanDerWaalsContact O-N 3.14Å; I48-I50 VanDerWaalsContact C-N 3.32Å; I48-I50 PolarHBondContact O-N 2.93Å; I48-R51 HydrophobicContact CD1-CB 4.3Å; I48-R51 PolarHBondContact O-N 2.97Å; I48-R132 PolarHBondContact O-NH2 3.13Å; I48-R132 VanDerWaalsContact O-NH2 3.12Å; I48-Y210 HydrophobicContact CD1-CD1 4.18Å; I48-Y210 HydrophobicContact CD1-CE1 3.42Å; I48-Y210 VanDerWaalsContact CD1-CE1 3.42Å; I48-Y210 HydrophobicContact CD1-CE2 4.37Å; I48-Y210 WeakPolarHBondContact CD1-OH 3.44Å; I48-Y210 HydrophobicContact CG1-CE1 4.46Å
49	E	95.2	Very high	94	Very high	24 Å²	24	89.5 Å²	89.5	11%	0.112	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-74.6	-24.7	-177.7	-63.5	-173.7	148.9	0	0	113.2	R46 L47 W105 L106 P130 R132	R46-E49 HydrophobicContact CB-CG 4.09Å; R46-E49 IonicContact CZ-OE1 3.59Å; R46-E49 IonicContact NE-OE1 3.41Å; R46-E49 PolarHBondContact NE-OE1 2.93Å; R46-E49 IonicContact NE-OE2 2.66Å; R46-E49 IonicContact NH1-OE1 2.83Å; R46-E49 IonicContact NH2-OE1 2.7Å; R46-E49 PolarHBondContact NH2-OE1 3.43Å; R46-E49 WeakPolarHBondContact O-CB 3.39Å; R46-E49 WeakPolarHBondContact O-CG 3.38Å; R46-E49 PolarHBondContact O-N 3.45Å; R46-E49 VanDerWaalsContact O-N 3.1Å; L47-E49 PolarHBondContact O-N 3.43Å; E49-W105 WeakPolarHBondContact OE1-CH2 3.48Å; E49-L106 WeakPolarHBondContact OE2-CD2 3.27Å; E49-P130 HydrophobicContact CB-CB 3.51Å; E49-P130 HydrophobicContact CB-CG 3.85Å; E49-P130 WeakPolarHBondContact OE2-CG 3.26Å; E49-R132 WeakPolarHBondContact O-CG 3.27Å; E49-R132 PolarHBondContact O-NE 3.14Å
50	I	96.3	Very high	94.3	Very high	41 Å²	41	83.4 Å²	83.4	21%	0.21	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-15	175	59.6	161.3	0	0	0	112.3	L47 I48 G72 G73 F74 P130	L47-I50 WeakPolarHBondContact O-CG1 3.43Å; L47-I50 PolarHBondContact O-N 3.31Å; I48-I50 VanDerWaalsContact C-N 3.32Å; I48-I50 PolarHBondContact O-N 2.93Å; I50-G72 WeakPolarHBondContact O-CA 3.34Å; I50-G73 VanDerWaalsContact CG2-O 3.28Å; I50-G73 WeakPolarHBondContact CG2-O 3.48Å; I50-F74 HydrophobicContact CB-CZ 4.37Å; I50-F74 HydrophobicContact CD1-CD2 4.45Å; I50-F74 HydrophobicContact CD1-CE2 3.68Å; I50-F74 HydrophobicContact CD1-CZ 3.94Å; I50-F74 HydrophobicContact CG1-CE2 4.25Å; I50-F74 HydrophobicContact CG1-CZ 3.99Å; I50-F74 HydrophobicContact CG2-CD1 3.86Å; I50-F74 HydrophobicContact CG2-CD2 4.32Å; I50-F74 HydrophobicContact CG2-CE1 3.43Å; I50-F74 VanDerWaalsContact CG2-CE1 3.43Å; I50-F74 HydrophobicContact CG2-CE2 3.95Å; I50-F74 HydrophobicContact CG2-CG 4.27Å; I50-F74 HydrophobicContact CG2-CZ 3.46Å; I50-F74 VanDerWaalsContact CG2-CZ 3.46Å; I50-P130 HydrophobicContact CG2-CB 3.97Å
51	R	95.9	Very high	94.6	Very high	63 Å²	63	82.8 Å²	82.8	24%	0.238	40%	0.397	C	S	.	.	S	Bend	trans	-84.4	138	-173.6	-152.4	-171.5	175.8	-155.3	-11.5	110.6	I48 D211 W214 R219	I48-R51 HydrophobicContact CD1-CB 4.3Å; I48-R51 PolarHBondContact O-N 2.97Å; R51-D211 IonicContact NH2-OD1 2.79Å; R51-W214 HydrophobicContact CB-CH2 3.77Å; R51-W214 HydrophobicContact CB-CZ3 4.32Å; R51-W214 HydrophobicContact CG-CH2 3.45Å; R51-W214 VanDerWaalsContact CG-CH2 3.45Å; R51-W214 HydrophobicContact CG-CZ3 3.5Å; R51-R219 PolarHBondContact NE-OXT 3.48Å; R51-R219 PolarHBondContact NH2-OXT 3.42Å
52	G	96	Very high	94.8	Very high	5 Å²	5	74.1 Å²	74.1	5%	0.052	37%	0.365	C	S	.	.	S	Bend	trans	84.7	-173.5	176.2	0	0	0	0	0	114.9	A133 W214	G52-A133 PolarHBondContact O-N 2.94Å; G52-W214 VanDerWaalsContact CA-CZ2 3.48Å
53	P	96.9	Very high	95	Very high	22 Å²	22	74.5 Å²	74.5	14%	0.143	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-76.5	149.9	179	28.7	-29.9	0	0	0	112.3	L55 R132 A133 W214 Y218	P53-L55 HydrophobicContact CG-CD2 4.45Å; P53-R132 WeakPolarHBondContact O-CD 3.35Å; P53-A133 CarbonylContact C-O 3.47Å; P53-W214 VanDerWaalsContact CD-CD1 3.49Å; P53-Y218 HydrophobicContact CB-CD2 4.32Å; P53-Y218 HydrophobicContact CB-CE1 4.29Å; P53-Y218 HydrophobicContact CB-CE2 3.63Å; P53-Y218 HydrophobicContact CG-CD2 4.1Å; P53-Y218 HydrophobicContact CG-CE2 3.76Å
54	E	97.2	Very high	95.2	Very high	29 Å²	29	75 Å²	75	14%	0.136	36%	0.364	C	S	.	.			trans	-71.8	133.8	161.5	-176.7	63.3	-166.7	0	0	109.9	H57 T58 R132 A133 R135	E54-H57 IonicContact OE1-CD2 2.99Å; E54-T58 HydrophobicContact CB-CG2 4.04Å; E54-T58 HydrophobicContact CG-CG2 4.22Å; E54-T58 VanDerWaalsContact O-CG2 3.31Å; E54-T58 WeakPolarHBondContact O-CG2 3.3Å; E54-R132 HydrophobicContact CB-CB 3.98Å; E54-A133 WeakPolarHBondContact CB-O 3.3Å; E54-A133 PolarHBondContact N-O 3.02Å; E54-R135 HydrophobicContact CB-CB 3.99Å; E54-R135 HydrophobicContact CG-CB 3.86Å; E54-R135 HydrophobicContact CG-CG 4.39Å; E54-R135 IonicContact OE1-CZ 3.64Å; E54-R135 IonicContact OE1-NH1 3.07Å; E54-R135 PolarHBondContact OE1-NH1 3.3Å
55	L	95.1	Very high	95.4	Very high	135 Å²	135	71.2 Å²	71.2	71%	0.707	34%	0.337	S	S	*	.	S	Bend	trans	-100.7	-29	-176.7	-60.6	178.5	0	0	0	113.5	P53	P53-L55 HydrophobicContact CG-CD2 4.45Å
56	V	95.6	Very high	95.7	Very high	110 Å²	110	63.7 Å²	63.7	67%	0.667	30%	0.304	S	S	*	.	S	Bend	trans	-105.8	-53.7	-166	-178.4	0	0	0	0	111.7	T58	V56-T58 PolarHBondContact O-N 3.45Å
57	H	96.7	Very high	95.9	Very high	67 Å²	67	58.2 Å²	58.2	31%	0.31	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	51.2	-170.1	-55.9	-106.1	0	0	0	112.5	E54 R135 I136	E54-H57 IonicContact OE1-CD2 2.99Å; H57-R135 PolarHBondContact CD2-NH1 3.15Å; H57-R135 PolarHBondContact CD2-NH2 3.29Å; H57-R135 VanDerWaalsContact CD2-NH2 3.31Å; H57-R135 VanDerWaalsContact CG-NH2 3.29Å; H57-R135 PolarHBondContact NE2-NH2 3.09Å; H57-I136 PolarHBondContact O-N 2.89Å; H57-I136 VanDerWaalsContact O-N 3.09Å
58	T	96.3	Very high	96	Very high	49 Å²	49	55.2 Å²	55.2	30%	0.301	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-20.4	174.9	37	0	0	0	0	113	E54 V56 G134 I136	E54-T58 HydrophobicContact CB-CG2 4.04Å; E54-T58 HydrophobicContact CG-CG2 4.22Å; E54-T58 VanDerWaalsContact O-CG2 3.31Å; E54-T58 WeakPolarHBondContact O-CG2 3.3Å; V56-T58 PolarHBondContact O-N 3.45Å; T58-G134 WeakPolarHBondContact CG2-O 3.33Å; T58-I136 WeakPolarHBondContact O-CD1 3.48Å
59	K	96.3	Very high	96.1	Very high	154 Å²	154	52 Å²	52	67%	0.67	25%	0.249	S	C	*	.	S	Bend	trans	-98.2	146.5	-177.9	-61.9	-177.5	178.9	-177	0	112.8	R100 I136	K59-R100 PolarHBondContact O-NH1 3.24Å; K59-R100 PolarHBondContact O-NH2 3.27Å; K59-I136 VanDerWaalsContact C-CD1 3.49Å
60	L	96.3	Very high	96.2	Very high	11 Å²	11	55.9 Å²	55.9	6%	0.058	27%	0.265	C	S	.	.			trans	-73.3	129.4	168.8	-64.9	170	0	0	0	109.5	I136 E139 Q169 L172	L60-I136 HydrophobicContact CD2-CD1 3.56Å; L60-I136 HydrophobicContact CD2-CG2 4.39Å; L60-I136 HydrophobicContact CG-CD1 3.87Å; L60-E139 WeakPolarHBondContact CA-OE1 3.44Å; L60-E139 HydrophobicContact CD2-CG 4.04Å; L60-Q169 HydrophobicContact CD1-CB 4.33Å; L60-L172 HydrophobicContact CD1-CD1 3.83Å; L60-L172 HydrophobicContact CG-CD1 3.84Å
61	I	95	Very high	96.2	Very high	99 Å²	99	58.7 Å²	58.7	51%	0.508	28%	0.28	S	S	.	.	S	Bend	trans	-80.7	-42.4	177.3	-69	165.6	0	0	0	109.3	R100 E139	I61-R100 VanDerWaalsContact CG1-NH1 3.31Å; I61-E139 PolarHBondContact N-OE1 3.03Å
62	H	94.2	Very high	96.2	Very high	13 Å²	13	57 Å²	57	6%	0.06	28%	0.282	C	S	.	.	S	Bend	trans	-92.2	-1.1	-176.9	-53.2	85.4	0	0	0	113	I14 P16 Q64 F96 I98 E139	I14-H62 PolarHBondContact O-CD2 2.89Å; I14-H62 VanDerWaalsContact O-CD2 3.27Å; P16-H62 VanDerWaalsContact CA-NE2 3.34Å; P16-H62 WeakPolarHBondContact CA-NE2 3.48Å; H62-Q64 VanDerWaalsContact C-N 3.31Å; H62-Q64 PolarHBondContact O-N 2.65Å; H62-F96 HydrophobicContact CB-CE2 4.08Å; H62-F96 HydrophobicContact CB-CZ 3.73Å; H62-F96 AromaticContact CD2-CE2 3.75Å; H62-F96 AromaticContact CD2-CZ 3.63Å; H62-F96 AromaticContact CG-CE2 3.69Å; H62-F96 AromaticContact CG-CZ 3.69Å; H62-I98 WeakPolarHBondContact CE1-CD1 3.25Å; H62-E139 HydrophobicContact CB-CG 4.49Å; H62-E139 IonicContact CE1-OE2 3.69Å; H62-E139 IonicContact CG-OE1 2.72Å; H62-E139 PolarHBondContact N-OE1 2.72Å; H62-E139 IonicContact ND1-OE1 3.67Å; H62-E139 PolarHBondContact ND1-OE1 2.67Å; H62-E139 IonicContact ND1-OE2 3.3Å; H62-E139 PolarHBondContact ND1-OE2 3.19Å
63	R	94.5	Very high	96.2	Very high	168 Å²	168	57.2 Å²	57.2	63%	0.634	29%	0.285	S	S	*	.	S	Bend	trans	57	32.8	168.8	-56.5	-176	179.3	-171.5	-0.2	115.7	I14 Q169	I14-R63 HydrophobicContact CD1-CG 4.45Å; R63-Q169 HydrophobicContact CB-CG 4.11Å; R63-Q169 VanDerWaalsContact O-CB 3.26Å; R63-Q169 WeakPolarHBondContact O-CB 2.96Å
64	Q	93.6	Very high	96.2	Very high	35 Å²	35	58.1 Å²	58.1	16%	0.164	29%	0.286	C	S	.	.	S	Bend	trans	-119.1	-84.7	175.5	-74.7	-175.9	-43.2	0	0	111.8	H62 G142 S168 Q169	H62-Q64 VanDerWaalsContact C-N 3.31Å; H62-Q64 PolarHBondContact O-N 2.65Å; Q64-G142 PolarHBondContact NE2-O 2.76Å; Q64-G142 PolarHBondContact OE1-O 2.73Å; Q64-S168 CarbonylContact O-C 3.55Å; Q64-S168 VanDerWaalsContact O-CA 3.25Å; Q64-S168 WeakPolarHBondContact O-CA 3.5Å; Q64-Q169 PolarHBondContact O-N 3.3Å
65	Y	96.7	Very high	96.2	Very high	29 Å²	29	56.8 Å²	56.8	11%	0.114	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	154	-177.1	-48.4	-74	0	0	0	111.8	L140 V144 V146 A149 M166 V167	Y65-L140 PolarHBondContact N-O 2.99Å; Y65-L140 PolarHBondContact O-N 2.88Å; Y65-V144 HydrophobicContact CE2-CB 4.36Å; Y65-V144 PolarHBondContact OH-O 3.23Å; Y65-V146 HydrophobicContact CE1-CG2 4.13Å; Y65-V146 VanDerWaalsContact OH-CG2 3.27Å; Y65-V146 WeakPolarHBondContact OH-CG2 3.09Å; Y65-A149 HydrophobicContact CD1-CB 4.15Å; Y65-A149 HydrophobicContact CD2-CB 3.79Å; Y65-A149 HydrophobicContact CE1-CB 4.4Å; Y65-A149 HydrophobicContact CE2-CB 4.06Å; Y65-A149 HydrophobicContact CG-CB 3.84Å; Y65-M166 HydrophobicContact CD1-CE 4.13Å; Y65-M166 HydrophobicContact CE1-CE 4.47Å; Y65-V167 CarbonylContact C-O 3.56Å; Y65-V167 WeakPolarHBondContact CA-O 3.24Å
66	G	97.3	Very high	96.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	164.4	171.5	0	0	0	0	0	113.5	V138 M166 V167	G66-V138 CarbonylContact C-O 3.51Å; G66-V138 VanDerWaalsContact CA-O 3.23Å; G66-V138 WeakPolarHBondContact CA-O 3.27Å; G66-M166 WeakPolarHBondContact O-CA 3.3Å; G66-V167 PolarHBondContact N-O 2.8Å; G66-V167 PolarHBondContact O-N 3.44Å
67	L	97.9	Very high	96.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	105.4	174	-175.6	62.5	0	0	0	108.9	I136 I137 V138 L153 A156 A157 L160 A164	L67-I136 WeakPolarHBondContact O-CA 3.35Å; L67-I137 PolarHBondContact O-N 2.91Å; L67-V138 HydrophobicContact CB-CB 4.15Å; L67-V138 HydrophobicContact CD2-CG2 4.47Å; L67-V138 PolarHBondContact N-O 3.01Å; L67-L153 HydrophobicContact CB-CD2 4.28Å; L67-A156 HydrophobicContact CD2-CB 3.88Å; L67-A157 HydrophobicContact CD1-CB 3.83Å; L67-L160 HydrophobicContact CD2-CD1 3.76Å; L67-L160 HydrophobicContact CG-CD1 4.28Å; L67-A164 HydrophobicContact CD1-CB 3.87Å; L67-A164 HydrophobicContact CG-CB 4.28Å
68	R	97.9	Very high	96.4	Very high	38 Å²	38	50.9 Å²	50.9	14%	0.143	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	133.7	-179.3	-178.5	174.8	72.5	-174.6	-2.2	110.9	A164 E165 V167 E175	R68-A164 CarbonylContact O-C 3.51Å; R68-A164 WeakPolarHBondContact O-CA 3.13Å; R68-A164 WeakPolarHBondContact O-CB 3.4Å; R68-E165 HydrophobicContact CB-CG 4.46Å; R68-E165 IonicContact CZ-OE1 3.71Å; R68-E165 VanDerWaalsContact CZ-OE1 3.26Å; R68-E165 PolarHBondContact N-O 2.96Å; R68-E165 IonicContact NE-OE1 3.78Å; R68-E165 PolarHBondContact NE-OE1 3.37Å; R68-E165 IonicContact NH2-OE1 2.87Å; R68-E165 PolarHBondContact NH2-OE1 3.12Å; R68-E165 PolarHBondContact O-N 3.09Å; R68-V167 HydrophobicContact CB-CG1 3.94Å; R68-V167 HydrophobicContact CB-CG2 3.97Å; R68-E175 IonicContact CZ-OE1 3.02Å; R68-E175 IonicContact CZ-OE2 3.73Å; R68-E175 VanDerWaalsContact CZ-OE2 3.28Å; R68-E175 IonicContact NH1-OE1 4Å; R68-E175 IonicContact NH1-OE2 2.73Å; R68-E175 PolarHBondContact NH1-OE2 3.08Å; R68-E175 VanDerWaalsContact NH2-CD 3.32Å; R68-E175 IonicContact NH2-OE1 3.88Å; R68-E175 PolarHBondContact NH2-OE1 3.22Å; R68-E175 IonicContact NH2-OE2 3.8Å; R68-E175 PolarHBondContact NH2-OE2 3.47Å
69	A	97.8	Very high	96.5	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	125.9	170	0	0	0	0	0	110.7	V131 G134 R135 I137 M162	A69-V131 HydrophobicContact CB-CG1 3.83Å; A69-G134 WeakPolarHBondContact O-CA 3.47Å; A69-G134 PolarHBondContact O-N 3.1Å; A69-R135 PolarHBondContact N-O 2.93Å; A69-I137 HydrophobicContact CB-CD1 4.22Å; A69-M162 HydrophobicContact CB-CE 3.77Å; A69-M162 HydrophobicContact CB-SD 4.48Å
70	K	96.2	Very high	96.5	Very high	105 Å²	105	42.9 Å²	42.9	46%	0.457	21%	0.21	S	C	.	.	S	Bend	trans	-77	-37.6	172.8	-69.9	-170.4	168.9	178.3	0	112.2	A133 P163 E165	K70-A133 WeakPolarHBondContact O-CB 3.4Å; K70-P163 HydrophobicContact CB-CB 4.28Å; K70-P163 HydrophobicContact CB-CG 4.18Å; K70-P163 WeakPolarHBondContact CB-O 3.32Å; K70-P163 HydrophobicContact CD-CB 4.49Å; K70-P163 PolarHBondContact N-O 2.89Å; K70-E165 WeakPolarHBondContact CE-OE1 3.33Å; K70-E165 WeakPolarHBondContact CE-OE2 3.37Å; K70-E165 IonicContact NZ-OE2 2.6Å; K70-E165 PolarHBondContact NZ-OE2 2.94Å
71	L	96.1	Very high	96.6	Very high	101 Å²	101	44.2 Å²	44.2	53%	0.529	22%	0.216	S	C	.	.	S	Bend	trans	-125.7	160	-178.8	-65	178.5	0	0	0	110.5	P163	L71-P163 HydrophobicContact CB-CG 4.09Å; L71-P163 HydrophobicContact CD1-CG 3.66Å; L71-P163 HydrophobicContact CG-CG 3.83Å
72	G	96.2	Very high	96.6	Very high	27 Å²	27	41.8 Å²	41.8	28%	0.278	21%	0.208	S	C	.	.			trans	-75.2	149.1	174	0	0	0	0	0	112.9	I50 V131	I50-G72 WeakPolarHBondContact O-CA 3.34Å; G72-V131 CarbonylContact C-O 3.53Å; G72-V131 WeakPolarHBondContact CA-O 3.45Å
73	G	96.6	Very high	96.8	Very high	10 Å²	10	41.2 Å²	41.2	10%	0.103	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	175.4	-177.8	0	0	0	0	0	113	I50 V131 M162	I50-G73 VanDerWaalsContact CG2-O 3.28Å; I50-G73 WeakPolarHBondContact CG2-O 3.48Å; G73-V131 PolarHBondContact N-O 2.78Å; G73-V131 PolarHBondContact O-N 2.77Å; G73-M162 VanDerWaalsContact CA-SD 3.59Å
74	F	97.5	Very high	96.9	Very high	40 Å²	40	36.3 Å²	36.3	18%	0.175	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124	178.5	-65	-69.3	0	0	0	110.7	L47 I50 L106 V128 P130 P161	L47-F74 HydrophobicContact CD2-CE2 4.07Å; L47-F74 HydrophobicContact CD2-CZ 4.08Å; I50-F74 HydrophobicContact CB-CZ 4.37Å; I50-F74 HydrophobicContact CD1-CD2 4.45Å; I50-F74 HydrophobicContact CD1-CE2 3.68Å; I50-F74 HydrophobicContact CD1-CZ 3.94Å; I50-F74 HydrophobicContact CG1-CE2 4.25Å; I50-F74 HydrophobicContact CG1-CZ 3.99Å; I50-F74 HydrophobicContact CG2-CD1 3.86Å; I50-F74 HydrophobicContact CG2-CD2 4.32Å; I50-F74 HydrophobicContact CG2-CE1 3.43Å; I50-F74 VanDerWaalsContact CG2-CE1 3.43Å; I50-F74 HydrophobicContact CG2-CE2 3.95Å; I50-F74 HydrophobicContact CG2-CG 4.27Å; I50-F74 HydrophobicContact CG2-CZ 3.46Å; I50-F74 VanDerWaalsContact CG2-CZ 3.46Å; F74-L106 HydrophobicContact CE1-CD2 4.01Å; F74-V128 HydrophobicContact CB-CB 4.15Å; F74-V128 HydrophobicContact CB-CG1 4.42Å; F74-V128 HydrophobicContact CB-CG2 4.21Å; F74-V128 HydrophobicContact CD1-CB 4.44Å; F74-V128 HydrophobicContact CD1-CG2 3.69Å; F74-V128 HydrophobicContact CE1-CG2 4.48Å; F74-V128 HydrophobicContact CG-CG2 4.19Å; F74-P130 HydrophobicContact CD1-CB 4.17Å; F74-P130 HydrophobicContact CE1-CB 3.95Å; F74-P161 WeakPolarHBondContact O-CG 3.43Å
75	L	97.3	Very high	96.9	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122.3	173	-59.7	-174.1	0	0	0	110.4	F80 V101 V128 T129 V131 I137 L160 P161 M162	L75-F80 HydrophobicContact CB-CD2 4.4Å; L75-F80 HydrophobicContact CB-CE2 3.64Å; L75-F80 HydrophobicContact CB-CZ 4.04Å; L75-F80 HydrophobicContact CD1-CE1 4.42Å; L75-F80 HydrophobicContact CD1-CE2 4.34Å; L75-F80 HydrophobicContact CD1-CZ 3.95Å; L75-V101 HydrophobicContact CD1-CG1 4.33Å; L75-V128 CarbonylContact O-C 3.55Å; L75-V128 VanDerWaalsContact O-CA 3.23Å; L75-V128 WeakPolarHBondContact O-CA 3.24Å; L75-V128 WeakPolarHBondContact O-CB 3.33Å; L75-T129 PolarHBondContact N-O 2.79Å; L75-T129 PolarHBondContact O-N 3.26Å; L75-V131 HydrophobicContact CD1-CG2 3.64Å; L75-V131 HydrophobicContact CG-CG2 3.76Å; L75-I137 HydrophobicContact CD1-CG2 4.05Å; L75-L160 HydrophobicContact CD2-CD2 3.38Å; L75-P161 HydrophobicContact CD2-CG 4.22Å; L75-M162 HydrophobicContact CD2-CE 3.88Å; L75-M162 HydrophobicContact CG-CE 4.39Å
76	H	97.4	Very high	96.8	Very high	61 Å²	61	40.5 Å²	40.5	28%	0.282	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	158	171.1	-66.5	-109.3	0	0	0	109.5	C78 H79 F80 H126	H76-C78 VanDerWaalsContact CB-SG 3.57Å; H76-C78 PolarHBondContact O-N 3.18Å; H76-C78 VanDerWaalsContact O-N 3.13Å; H76-H79 AromaticContact CD2-CE1 3.61Å; H76-H79 PolarHBondContact N-ND1 3.1Å; H76-H79 VanDerWaalsContact N-ND1 3.2Å; H76-H79 WeakPolarHBondContact O-CB 3.45Å; H76-H79 PolarHBondContact O-N 3.01Å; H76-F80 WeakPolarHBondContact O-CD2 3.37Å; H76-F80 PolarHBondContact O-N 3.47Å; H76-H126 AromaticContact CE1-CD2 3.62Å; H76-H126 AromaticContact CE1-CE1 3.98Å; H76-H126 AromaticContact CE1-NE2 3.07Å; H76-H126 PolarHBondContact CE1-NE2 3.05Å; H76-H126 AromaticContact ND1-CD2 3.38Å; H76-H126 PolarHBondContact ND1-CD2 3.05Å; H76-H126 AromaticContact ND1-NE2 3.37Å; H76-H126 PolarHBondContact ND1-NE2 2.93Å
77	H	97.1	Very high	96.8	Very high	58 Å²	58	40.5 Å²	40.5	27%	0.269	21%	0.207	S	C	.	.	H	α-helix	trans	-51.7	-36.5	175.6	172.5	78.2	0	0	0	113.2	V26 K28 H79 F80 E81 P104	V26-H77 PolarHBondContact O-CE1 3.4Å; V26-H77 PolarHBondContact O-ND1 3.3Å; K28-H77 HydrophobicContact CB-CB 4.43Å; K28-H77 HydrophobicContact CG-CB 4.11Å; H77-H79 VanDerWaalsContact C-N 3.29Å; H77-H79 PolarHBondContact O-N 3.16Å; H77-F80 PolarHBondContact O-N 3.33Å; H77-E81 PolarHBondContact O-N 3.31Å; H77-E81 VanDerWaalsContact O-N 3.12Å; H77-P104 HydrophobicContact CB-CG 4.31Å
78	C	96.9	Very high	96.7	Very high	69 Å²	69	41.6 Å²	41.6	47%	0.466	21%	0.213	S	C	.	.	H	α-helix	trans	-61.6	-34.6	176.4	55.5	0	0	0	0	113.2	H76 E81 S82	H76-C78 VanDerWaalsContact CB-SG 3.57Å; H76-C78 PolarHBondContact O-N 3.18Å; H76-C78 VanDerWaalsContact O-N 3.13Å; C78-E81 PolarHBondContact O-N 2.82Å; C78-S82 WeakPolarHBondContact O-CB 3.3Å; C78-S82 PolarHBondContact O-N 3.21Å; C78-S82 PolarHBondContact O-OG 2.7Å; C78-S82 VanDerWaalsContact O-OG 3.05Å
79	H	97.1	Very high	96.5	Very high	32 Å²	32	44.9 Å²	44.9	15%	0.148	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-41.3	178.1	-53.9	152.9	0	0	0	110.9	H76 H77 E81 S82 I83	H76-H79 AromaticContact CD2-CE1 3.61Å; H76-H79 PolarHBondContact N-ND1 3.1Å; H76-H79 VanDerWaalsContact N-ND1 3.2Å; H76-H79 WeakPolarHBondContact O-CB 3.45Å; H76-H79 PolarHBondContact O-N 3.01Å; H77-H79 VanDerWaalsContact C-N 3.29Å; H77-H79 PolarHBondContact O-N 3.16Å; H79-E81 VanDerWaalsContact C-N 3.35Å; H79-E81 PolarHBondContact O-N 2.68Å; H79-S82 PolarHBondContact O-N 3.23Å; H79-I83 WeakPolarHBondContact O-CB 3.21Å; H79-I83 WeakPolarHBondContact O-CD1 3.43Å; H79-I83 VanDerWaalsContact O-CG1 3.26Å; H79-I83 WeakPolarHBondContact O-CG1 3.16Å; H79-I83 PolarHBondContact O-N 2.94Å
80	F	97.5	Very high	96.3	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-59.2	-46.5	174.2	-72.6	-83.6	0	0	0	111.4	V26 L75 H76 H77 I83 R84 W99 V101 P104	V26-F80 HydrophobicContact CB-CB 4.15Å; V26-F80 HydrophobicContact CB-CD1 4.46Å; V26-F80 HydrophobicContact CB-CG 4.31Å; V26-F80 HydrophobicContact CG1-CD1 4.35Å; V26-F80 HydrophobicContact CG1-CG 4.24Å; V26-F80 HydrophobicContact CG2-CB 4.09Å; V26-F80 HydrophobicContact CG2-CD1 3.89Å; V26-F80 HydrophobicContact CG2-CG 4.18Å; L75-F80 HydrophobicContact CB-CD2 4.4Å; L75-F80 HydrophobicContact CB-CE2 3.64Å; L75-F80 HydrophobicContact CB-CZ 4.04Å; L75-F80 HydrophobicContact CD1-CE1 4.42Å; L75-F80 HydrophobicContact CD1-CE2 4.34Å; L75-F80 HydrophobicContact CD1-CZ 3.95Å; H76-F80 WeakPolarHBondContact O-CD2 3.37Å; H76-F80 PolarHBondContact O-N 3.47Å; H77-F80 PolarHBondContact O-N 3.33Å; F80-I83 PolarHBondContact O-N 3.12Å; F80-R84 WeakPolarHBondContact O-CB 3.12Å; F80-R84 PolarHBondContact O-N 3.29Å; F80-W99 HydrophobicContact CB-CH2 4.28Å; F80-W99 HydrophobicContact CB-CZ2 4.36Å; F80-W99 HydrophobicContact CD1-CD2 4.24Å; F80-W99 AromaticContact CD1-CE3 3.94Å; F80-W99 HydrophobicContact CD1-CE3 3.94Å; F80-W99 AromaticContact CD1-CH2 3.74Å; F80-W99 HydrophobicContact CD1-CH2 3.74Å; F80-W99 HydrophobicContact CD1-CZ2 4.05Å; F80-W99 AromaticContact CD1-CZ3 3.69Å; F80-W99 HydrophobicContact CD1-CZ3 3.69Å; F80-W99 HydrophobicContact CE1-CE3 4.15Å; F80-W99 HydrophobicContact CE1-CZ3 4.19Å; F80-W99 HydrophobicContact CG-CH2 4.47Å; F80-V101 HydrophobicContact CE1-CG1 4.37Å; F80-V101 HydrophobicContact CZ-CG1 4.06Å; F80-P104 HydrophobicContact CD2-CG 4.08Å; F80-P104 HydrophobicContact CE2-CG 3.85Å
81	E	96.9	Very high	96.2	Very high	40 Å²	40	46.1 Å²	46.1	19%	0.187	24%	0.242	C	C	.	.	H	α-helix	trans	-67.7	-38.4	-178.7	-173.2	58.8	-166.7	0	0	112.4	H77 C78 H79 R84 K85	H77-E81 PolarHBondContact O-N 3.31Å; H77-E81 VanDerWaalsContact O-N 3.12Å; C78-E81 PolarHBondContact O-N 2.82Å; H79-E81 VanDerWaalsContact C-N 3.35Å; H79-E81 PolarHBondContact O-N 2.68Å; E81-R84 PolarHBondContact O-N 3.17Å; E81-R84 IonicContact OE1-CZ 2.95Å; E81-R84 IonicContact OE1-NE 3.14Å; E81-R84 PolarHBondContact OE1-NE 2.86Å; E81-R84 IonicContact OE1-NH2 2.78Å; E81-R84 PolarHBondContact OE1-NH2 3.28Å; E81-R84 IonicContact OE2-CZ 2.77Å; E81-R84 IonicContact OE2-NE 3Å; E81-R84 PolarHBondContact OE2-NE 3.13Å; E81-R84 IonicContact OE2-NH2 3.43Å; E81-K85 HydrophobicContact CG-CD 4.34Å; E81-K85 WeakPolarHBondContact O-CB 3.49Å; E81-K85 WeakPolarHBondContact O-CG 3.46Å; E81-K85 PolarHBondContact O-N 3.44Å; E81-K85 WeakPolarHBondContact OE1-CE 3.41Å
82	S	96.6	Very high	96	Very high	48 Å²	48	45.4 Å²	45.4	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-40.1	175.8	-62.9	0	0	0	0	112.7	C78 H79 K85 S86	C78-S82 WeakPolarHBondContact O-CB 3.3Å; C78-S82 PolarHBondContact O-N 3.21Å; C78-S82 PolarHBondContact O-OG 2.7Å; C78-S82 VanDerWaalsContact O-OG 3.05Å; H79-S82 PolarHBondContact O-N 3.23Å; S82-K85 PolarHBondContact O-N 2.94Å; S82-S86 WeakPolarHBondContact O-CB 3.39Å; S82-S86 PolarHBondContact O-N 3.03Å
83	I	97.1	Very high	95.6	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-46.7	173.9	-69.8	166	0	0	0	109.9	L23 H79 F80 K85 S86 V87 W99 V138 A156 L160	L23-I83 HydrophobicContact CD1-CG2 4.21Å; H79-I83 WeakPolarHBondContact O-CB 3.21Å; H79-I83 WeakPolarHBondContact O-CD1 3.43Å; H79-I83 VanDerWaalsContact O-CG1 3.26Å; H79-I83 WeakPolarHBondContact O-CG1 3.16Å; H79-I83 PolarHBondContact O-N 2.94Å; F80-I83 PolarHBondContact O-N 3.12Å; I83-K85 VanDerWaalsContact C-N 3.33Å; I83-K85 PolarHBondContact O-N 3.27Å; I83-S86 WeakPolarHBondContact O-CB 3.47Å; I83-S86 PolarHBondContact O-N 3.05Å; I83-V87 HydrophobicContact CG2-CG2 4.18Å; I83-V87 WeakPolarHBondContact O-CB 3.46Å; I83-V87 WeakPolarHBondContact O-CG2 3.43Å; I83-V87 PolarHBondContact O-N 3.5Å; I83-W99 HydrophobicContact CB-CH2 3.8Å; I83-W99 HydrophobicContact CB-CZ3 4.45Å; I83-W99 HydrophobicContact CD1-CH2 4.42Å; I83-W99 HydrophobicContact CD1-CZ3 4.4Å; I83-W99 HydrophobicContact CG2-CH2 3.51Å; I83-W99 HydrophobicContact CG2-CZ2 4.49Å; I83-W99 HydrophobicContact CG2-CZ3 3.92Å; I83-V138 HydrophobicContact CG2-CG2 3.92Å; I83-A156 HydrophobicContact CG1-CB 4.21Å; I83-A156 HydrophobicContact CG2-CB 4.13Å; I83-L160 HydrophobicContact CD1-CD2 3.66Å; I83-L160 HydrophobicContact CD1-CG 4.08Å
84	R	96.6	Very high	95.4	Very high	64 Å²	64	55.8 Å²	55.8	24%	0.242	28%	0.278	C	S	.	.	H	α-helix	trans	-55.9	-47	177.3	-168.2	-175.6	76.2	81	1.9	111.8	L23 F80 E81 S86 V87 N88 W99	L23-R84 HydrophobicContact CB-CG 4.01Å; L23-R84 WeakPolarHBondContact O-CD 3.3Å; L23-R84 WeakPolarHBondContact O-CG 3.1Å; F80-R84 WeakPolarHBondContact O-CB 3.12Å; F80-R84 PolarHBondContact O-N 3.29Å; E81-R84 PolarHBondContact O-N 3.17Å; E81-R84 IonicContact OE1-CZ 2.95Å; E81-R84 IonicContact OE1-NE 3.14Å; E81-R84 PolarHBondContact OE1-NE 2.86Å; E81-R84 IonicContact OE1-NH2 2.78Å; E81-R84 PolarHBondContact OE1-NH2 3.28Å; E81-R84 IonicContact OE2-CZ 2.77Å; E81-R84 IonicContact OE2-NE 3Å; E81-R84 PolarHBondContact OE2-NE 3.13Å; E81-R84 IonicContact OE2-NH2 3.43Å; R84-S86 VanDerWaalsContact C-N 3.3Å; R84-S86 PolarHBondContact O-N 3.29Å; R84-V87 PolarHBondContact O-N 3.02Å; R84-N88 WeakPolarHBondContact CG-ND2 3.43Å; R84-N88 WeakPolarHBondContact O-CB 3.44Å; R84-N88 PolarHBondContact O-N 3.01Å; R84-W99 HydrophobicContact CB-CZ2 4.32Å
85	K	95.2	Very high	95.2	Very high	135 Å²	135	53.9 Å²	53.9	59%	0.587	27%	0.27	S	S	*	.	H	α-helix	trans	-67	-27.3	177.1	-74.1	178.7	178.6	178.6	0	113.5	E81 S82 I83 P89	E81-K85 HydrophobicContact CG-CD 4.34Å; E81-K85 WeakPolarHBondContact O-CB 3.49Å; E81-K85 WeakPolarHBondContact O-CG 3.46Å; E81-K85 PolarHBondContact O-N 3.44Å; E81-K85 WeakPolarHBondContact OE1-CE 3.41Å; S82-K85 PolarHBondContact O-N 2.94Å; I83-K85 VanDerWaalsContact C-N 3.33Å; I83-K85 PolarHBondContact O-N 3.27Å; K85-P89 WeakPolarHBondContact O-CD 3.18Å; K85-P89 VanDerWaalsContact O-CG 3.26Å; K85-P89 WeakPolarHBondContact O-CG 3.4Å
86	S	94.7	Very high	95.2	Very high	18 Å²	18	53.9 Å²	53.9	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-78.7	-39.7	175.5	-173	0	0	0	0	112.1	S82 I83 R84 R90 N155	S82-S86 WeakPolarHBondContact O-CB 3.39Å; S82-S86 PolarHBondContact O-N 3.03Å; I83-S86 WeakPolarHBondContact O-CB 3.47Å; I83-S86 PolarHBondContact O-N 3.05Å; R84-S86 VanDerWaalsContact C-N 3.3Å; R84-S86 PolarHBondContact O-N 3.29Å; S86-R90 PolarHBondContact O-NH1 3.48Å; S86-R90 PolarHBondContact OG-NH1 2.76Å; S86-N155 WeakPolarHBondContact OG-CB 3.31Å
87	V	96.2	Very high	95.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-86.7	-52.5	-172.1	173.6	0	0	0	0	111.8	L23 I83 R84 R90 L91 A97 M152 A156	L23-V87 HydrophobicContact CD1-CB 3.94Å; L23-V87 HydrophobicContact CD1-CG1 3.95Å; L23-V87 HydrophobicContact CD1-CG2 4.35Å; I83-V87 HydrophobicContact CG2-CG2 4.18Å; I83-V87 WeakPolarHBondContact O-CB 3.46Å; I83-V87 WeakPolarHBondContact O-CG2 3.43Å; I83-V87 PolarHBondContact O-N 3.5Å; R84-V87 PolarHBondContact O-N 3.02Å; V87-R90 PolarHBondContact O-N 3.37Å; V87-R90 VanDerWaalsContact O-N 3.11Å; V87-L91 PolarHBondContact O-N 2.73Å; V87-A97 HydrophobicContact CG1-CB 3.71Å; V87-M152 HydrophobicContact CG1-CE 3.79Å; V87-M152 WeakPolarHBondContact O-CE 3.36Å; V87-A156 HydrophobicContact CG2-CB 4.31Å
88	N	95.9	Very high	95.1	Very high	23 Å²	23	50 Å²	50	12%	0.123	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-58.4	-42.8	-169.7	-71.1	3.8	0	0	0	114.5	L23 R84 R90 L91	L23-N88 VanDerWaalsContact CB-OD1 3.32Å; L23-N88 WeakPolarHBondContact CB-OD1 3.23Å; L23-N88 PolarHBondContact N-OD1 3.13Å; L23-N88 PolarHBondContact O-ND2 3.31Å; R84-N88 WeakPolarHBondContact CG-ND2 3.43Å; R84-N88 WeakPolarHBondContact O-CB 3.44Å; R84-N88 PolarHBondContact O-N 3.01Å; N88-R90 PolarHBondContact O-N 2.77Å; N88-R90 VanDerWaalsContact O-N 3.17Å; N88-L91 WeakPolarHBondContact O-CB 3.41Å; N88-L91 PolarHBondContact O-N 2.96Å
89	P	93.8	Very high	95.1	Very high	106 Å²	106	48.5 Å²	48.5	69%	0.688	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-67.9	-14.8	-178.4	-22.2	35.5	0	0	0	114.5	K85	K85-P89 WeakPolarHBondContact O-CD 3.18Å; K85-P89 VanDerWaalsContact O-CG 3.26Å; K85-P89 WeakPolarHBondContact O-CG 3.4Å
90	R	93.5	Very high	95	Very high	120 Å²	120	48.1 Å²	48.1	45%	0.453	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-104.4	1.8	-179.5	-59	-179.2	-173.7	121.9	-5.7	112.3	S86 V87 N88 M152 N155	S86-R90 PolarHBondContact O-NH1 3.48Å; S86-R90 PolarHBondContact OG-NH1 2.76Å; V87-R90 PolarHBondContact O-N 3.37Å; V87-R90 VanDerWaalsContact O-N 3.11Å; N88-R90 PolarHBondContact O-N 2.77Å; N88-R90 VanDerWaalsContact O-N 3.17Å; R90-M152 HydrophobicContact CB-CE 4.05Å; R90-M152 HydrophobicContact CB-CG 3.93Å; R90-M152 HydrophobicContact CB-SD 4.02Å; R90-N155 PolarHBondContact NH1-ND2 2.77Å; R90-N155 PolarHBondContact NH2-ND2 2.95Å
91	L	93.6	Very high	95	Very high	12 Å²	12	48.5 Å²	48.5	6%	0.063	24%	0.238	C	C	.	.			trans	-89.5	120.6	-176.3	-162.8	78.1	0	0	0	109.4	R21 Y22 V87 N88 A95 A97 L140 M152	R21-L91 WeakPolarHBondContact O-CD2 3.15Å; Y22-L91 HydrophobicContact CD1-CB 4.18Å; Y22-L91 HydrophobicContact CD1-CD2 3.57Å; Y22-L91 HydrophobicContact CD1-CG 4.43Å; Y22-L91 HydrophobicContact CE1-CB 4.17Å; Y22-L91 HydrophobicContact CE1-CD2 3.99Å; Y22-L91 HydrophobicContact CE1-CG 4.49Å; Y22-L91 HydrophobicContact CG-CD2 4.28Å; V87-L91 PolarHBondContact O-N 2.73Å; N88-L91 WeakPolarHBondContact O-CB 3.41Å; N88-L91 PolarHBondContact O-N 2.96Å; L91-A95 HydrophobicContact CD1-CB 3.63Å; L91-A95 HydrophobicContact CG-CB 3.9Å; L91-A97 HydrophobicContact CD1-CB 4.22Å; L91-A97 HydrophobicContact CD2-CB 4.23Å; L91-L140 HydrophobicContact CD1-CD1 3.48Å; L91-L140 VanDerWaalsContact CD1-CD1 3.48Å; L91-M152 HydrophobicContact CB-CE 4.25Å; L91-M152 HydrophobicContact CD1-CE 3.78Å
92	D	91.9	Very high	95	Very high	86 Å²	86	51.2 Å²	51.2	46%	0.46	25%	0.254	S	S	.	.			trans	-73.2	158.4	173.6	-66.3	-29.8	0	0	0	111.2	K94 A95	D92-K94 PolarHBondContact O-N 2.91Å; D92-K94 VanDerWaalsContact O-N 3.1Å; D92-A95 HydrophobicContact CB-CB 4.49Å; D92-A95 WeakPolarHBondContact O-CA 3.33Å; D92-A95 WeakPolarHBondContact O-CB 3.32Å; D92-A95 PolarHBondContact O-N 3.49Å
93	D	89.2	Confident	95	Very high	115 Å²	115	51.8 Å²	51.8	62%	0.615	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-29.2	179.3	-64.1	-21.8	0	0	0	112.5	R21 Y22 A95	R21-D93 WeakPolarHBondContact CD-O 3.48Å; R21-D93 PolarHBondContact NH1-O 3.44Å; Y22-D93 PolarHBondContact OH-OD1 2.87Å; D93-A95 VanDerWaalsContact C-N 3.27Å; D93-A95 PolarHBondContact O-N 2.94Å
94	K	91.2	Very high	95	Very high	139 Å²	139	51.8 Å²	51.8	60%	0.604	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	1.6	178.3	-61.9	-178.5	-176.1	176.5	0	113.7	D92 G142 H143	D92-K94 PolarHBondContact O-N 2.91Å; D92-K94 VanDerWaalsContact O-N 3.1Å; K94-G142 VanDerWaalsContact O-CA 3.3Å; K94-G142 WeakPolarHBondContact O-CA 3.15Å; K94-H143 HydrophobicContact CB-CB 4.02Å; K94-H143 PolarHBondContact O-N 3.17Å; K94-H143 VanDerWaalsContact O-N 3.08Å; K94-H143 PolarHBondContact O-ND1 2.78Å
95	A	94.2	Very high	95	Very high	1 Å²	1	53 Å²	53	1%	0.008	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	162.4	176.6	0	0	0	0	0	111.1	R21 L91 D92 D93 G141 V144	R21-A95 WeakPolarHBondContact CB-O 3.41Å; L91-A95 HydrophobicContact CD1-CB 3.63Å; L91-A95 HydrophobicContact CG-CB 3.9Å; D92-A95 HydrophobicContact CB-CB 4.49Å; D92-A95 WeakPolarHBondContact O-CA 3.33Å; D92-A95 WeakPolarHBondContact O-CB 3.32Å; D92-A95 PolarHBondContact O-N 3.49Å; D93-A95 VanDerWaalsContact C-N 3.27Å; D93-A95 PolarHBondContact O-N 2.94Å; A95-G141 CarbonylContact C-O 3.5Å; A95-G141 VanDerWaalsContact CA-O 3.3Å; A95-G141 WeakPolarHBondContact CA-O 3.34Å; A95-V144 HydrophobicContact CB-CG2 3.4Å
96	F	95.9	Very high	95.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	150.2	172.6	65.7	-93.4	0	0	0	111.1	V13 I14 F15 P16 R21 H62 I98 L140 G141 G142	V13-F96 HydrophobicContact CG1-CE1 4.16Å; I14-F96 WeakPolarHBondContact O-CZ 3.15Å; F15-F96 AromaticContact CD1-CD1 3.4Å; F15-F96 HydrophobicContact CD1-CD1 3.4Å; F15-F96 AromaticContact CD1-CE1 3.64Å; F15-F96 HydrophobicContact CD1-CE1 3.64Å; F15-F96 HydrophobicContact CD1-CG 4.49Å; F15-F96 AromaticContact CE1-CD1 3.7Å; F15-F96 HydrophobicContact CE1-CD1 3.7Å; F15-F96 HydrophobicContact CE1-CE1 4.05Å; F15-F96 HydrophobicContact CG-CD1 4.35Å; F15-F96 HydrophobicContact CG-CE1 4.2Å; P16-F96 HydrophobicContact CG-CB 4.43Å; P16-F96 HydrophobicContact CG-CD2 3.96Å; P16-F96 HydrophobicContact CG-CE2 4.35Å; P16-F96 HydrophobicContact CG-CG 4.06Å; R21-F96 HydrophobicContact CB-CB 4.12Å; R21-F96 HydrophobicContact CG-CB 4.26Å; R21-F96 CarbonylContact O-C 3.42Å; R21-F96 WeakPolarHBondContact O-CA 3.42Å; H62-F96 HydrophobicContact CB-CE2 4.08Å; H62-F96 HydrophobicContact CB-CZ 3.73Å; H62-F96 AromaticContact CD2-CE2 3.75Å; H62-F96 AromaticContact CD2-CZ 3.63Å; H62-F96 AromaticContact CG-CE2 3.69Å; H62-F96 AromaticContact CG-CZ 3.69Å; F96-I98 HydrophobicContact CD2-CD1 3.56Å; F96-I98 HydrophobicContact CD2-CG1 3.93Å; F96-I98 HydrophobicContact CE2-CD1 3.65Å; F96-I98 HydrophobicContact CE2-CG1 4.46Å; F96-L140 WeakPolarHBondContact O-CA 3.29Å; F96-L140 WeakPolarHBondContact O-CD1 3.35Å; F96-G141 VanDerWaalsContact CD1-C 3.5Å; F96-G141 PolarHBondContact N-O 3.21Å; F96-G141 PolarHBondContact O-N 3.46Å; F96-G142 VanDerWaalsContact CE1-N 3.3Å
97	A	96.6	Very high	95.2	Very high	2 Å²	2	46.3 Å²	46.3	2%	0.017	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.7	173.4	0	0	0	0	0	109.8	R21 L23 V87 L91 E139 L140	R21-A97 PolarHBondContact O-N 2.68Å; L23-A97 HydrophobicContact CD1-CB 4.3Å; L23-A97 HydrophobicContact CD2-CB 4Å; L23-A97 WeakPolarHBondContact CD2-O 3.49Å; L23-A97 HydrophobicContact CG-CB 3.75Å; V87-A97 HydrophobicContact CG1-CB 3.71Å; L91-A97 HydrophobicContact CD1-CB 4.22Å; L91-A97 HydrophobicContact CD2-CB 4.23Å; A97-E139 CarbonylContact C-O 3.56Å; A97-E139 VanDerWaalsContact CA-O 3.3Å; A97-E139 WeakPolarHBondContact CA-O 3.43Å; A97-L140 HydrophobicContact CB-CD1 4.09Å
98	I	95.9	Very high	95.2	Very high	37 Å²	37	48.1 Å²	48.1	19%	0.19	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.4	-173.5	-58.8	157	0	0	0	110.2	P16 L23 H62 F96 R100 V138 E139	P16-I98 HydrophobicContact CB-CD1 3.5Å; P16-I98 HydrophobicContact CB-CG1 4.41Å; P16-I98 HydrophobicContact CG-CD1 3.68Å; P16-I98 HydrophobicContact CG-CG1 4.35Å; L23-I98 VanDerWaalsContact CD2-C 3.44Å; H62-I98 WeakPolarHBondContact CE1-CD1 3.25Å; F96-I98 HydrophobicContact CD2-CD1 3.56Å; F96-I98 HydrophobicContact CD2-CG1 3.93Å; F96-I98 HydrophobicContact CE2-CD1 3.65Å; F96-I98 HydrophobicContact CE2-CG1 4.46Å; I98-R100 PolarHBondContact O-N 2.87Å; I98-V138 WeakPolarHBondContact O-CA 3.47Å; I98-E139 PolarHBondContact N-O 3.32Å; I98-E139 PolarHBondContact O-N 3.26Å
99	W	96.9	Very high	95.1	Very high	36 Å²	36	49.4 Å²	49.4	14%	0.136	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.4	167.7	-67.7	119.3	0	0	0	110.6	L23 P24 V26 F80 I83 R84 I137 V138	L23-W99 HydrophobicContact CB-CZ2 4.16Å; L23-W99 HydrophobicContact CD1-CH2 4.16Å; L23-W99 HydrophobicContact CD1-CZ2 3.91Å; L23-W99 HydrophobicContact CD2-CD2 3.8Å; L23-W99 HydrophobicContact CD2-CE3 4.37Å; L23-W99 HydrophobicContact CD2-CG 3.94Å; L23-W99 HydrophobicContact CD2-CZ2 4.32Å; L23-W99 HydrophobicContact CG-CZ2 4.37Å; P24-W99 PolarHBondContact O-NE1 3.09Å; P24-W99 VanDerWaalsContact O-NE1 3.09Å; V26-W99 HydrophobicContact CG2-CZ2 4.28Å; F80-W99 HydrophobicContact CB-CH2 4.28Å; F80-W99 HydrophobicContact CB-CZ2 4.36Å; F80-W99 HydrophobicContact CD1-CD2 4.24Å; F80-W99 AromaticContact CD1-CE3 3.94Å; F80-W99 HydrophobicContact CD1-CE3 3.94Å; F80-W99 AromaticContact CD1-CH2 3.74Å; F80-W99 HydrophobicContact CD1-CH2 3.74Å; F80-W99 HydrophobicContact CD1-CZ2 4.05Å; F80-W99 AromaticContact CD1-CZ3 3.69Å; F80-W99 HydrophobicContact CD1-CZ3 3.69Å; F80-W99 HydrophobicContact CE1-CE3 4.15Å; F80-W99 HydrophobicContact CE1-CZ3 4.19Å; F80-W99 HydrophobicContact CG-CH2 4.47Å; I83-W99 HydrophobicContact CB-CH2 3.8Å; I83-W99 HydrophobicContact CB-CZ3 4.45Å; I83-W99 HydrophobicContact CD1-CH2 4.42Å; I83-W99 HydrophobicContact CD1-CZ3 4.4Å; I83-W99 HydrophobicContact CG2-CH2 3.51Å; I83-W99 HydrophobicContact CG2-CZ2 4.49Å; I83-W99 HydrophobicContact CG2-CZ3 3.92Å; R84-W99 HydrophobicContact CB-CZ2 4.32Å; W99-I137 HydrophobicContact CZ3-CG2 4.42Å; W99-V138 HydrophobicContact CE3-CG2 3.71Å; W99-V138 HydrophobicContact CH2-CG2 4.3Å; W99-V138 HydrophobicContact CZ3-CG2 3.44Å; W99-V138 VanDerWaalsContact CZ3-CG2 3.44Å
100	R	96.8	Very high	95.1	Very high	24 Å²	24	50.9 Å²	50.9	9%	0.091	24%	0.242	C	C	.	.			trans	-98.9	6	171.1	-71.3	-68.9	-62.6	-89	-5.8	112.1	K59 I61 I98 R135 I136 I137 E139	K59-R100 PolarHBondContact O-NH1 3.24Å; K59-R100 PolarHBondContact O-NH2 3.27Å; I61-R100 VanDerWaalsContact CG1-NH1 3.31Å; I98-R100 PolarHBondContact O-N 2.87Å; R100-R135 PolarHBondContact O-NE 3Å; R100-R135 PolarHBondContact O-NH2 3.44Å; R100-I136 HydrophobicContact CB-CG2 4.35Å; R100-I136 WeakPolarHBondContact CB-O 3.29Å; R100-I136 HydrophobicContact CG-CG2 4.17Å; R100-I137 PolarHBondContact N-O 3.42Å; R100-E139 WeakPolarHBondContact CD-OE2 3.33Å; R100-E139 HydrophobicContact CG-CB 3.84Å; R100-E139 IonicContact CZ-OE2 2.93Å; R100-E139 IonicContact NE-OE2 2.7Å; R100-E139 IonicContact NH1-OE1 3.13Å; R100-E139 IonicContact NH1-OE2 3.73Å; R100-E139 PolarHBondContact NH1-OE2 3.34Å
101	V	96.8	Very high	95.1	Very high	12 Å²	12	48.6 Å²	48.6	7%	0.073	24%	0.242	C	C	.	.	S	Bend	trans	-128	142.8	-177.8	171.9	0	0	0	0	109.5	L75 F80 T129 V131 R135 I137	L75-V101 HydrophobicContact CD1-CG1 4.33Å; F80-V101 HydrophobicContact CE1-CG1 4.37Å; F80-V101 HydrophobicContact CZ-CG1 4.06Å; V101-T129 HydrophobicContact CG1-CG2 3.4Å; V101-V131 HydrophobicContact CG1-CG2 4.24Å; V101-V131 HydrophobicContact CG2-CG2 4.46Å; V101-R135 HydrophobicContact CG2-CG 4.1Å; V101-I137 HydrophobicContact CG2-CB 4.35Å; V101-I137 HydrophobicContact CG2-CG1 4.44Å; V101-I137 HydrophobicContact CG2-CG2 4.26Å
102	D	96.3	Very high	95	Very high	97 Å²	97	51.3 Å²	51.3	52%	0.519	26%	0.26	S	S	.	.			trans	-67.9	154.1	-179	-59.6	-49.1	0	0	0	112.6	T129	D102-T129 WeakPolarHBondContact O-CG2 3.23Å; D102-T129 PolarHBondContact O-OG1 3.49Å
103	P	97.3	Very high	95.1	Very high	59 Å²	59	56.9 Å²	56.9	38%	0.383	28%	0.283	S	S	.	.			trans	-56.8	156.3	171.2	24.9	-35.2	0	0	0	111.9	V26 P27 W105 T129	V26-P103 HydrophobicContact CG1-CB 3.65Å; P27-P103 HydrophobicContact CG-CB 3.9Å; P103-W105 VanDerWaalsContact O-CD1 3.29Å; P103-W105 PolarHBondContact O-N 2.65Å; P103-W105 VanDerWaalsContact O-N 3.07Å; P103-T129 VanDerWaalsContact C-OG1 3.29Å; P103-T129 PolarHBondContact O-OG1 2.66Å
104	P	97.3	Very high	95.3	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	30%	0.295	C	S	.	.	S	Bend	trans	-52.3	115.8	176.2	-27.4	34.6	0	0	0	112.7	H77 F80 T129	H77-P104 HydrophobicContact CB-CG 4.31Å; F80-P104 HydrophobicContact CD2-CG 4.08Å; F80-P104 HydrophobicContact CE2-CG 3.85Å; P104-T129 VanDerWaalsContact CA-OG1 3.27Å; P104-T129 WeakPolarHBondContact CA-OG1 3.41Å
105	W	95.9	Very high	95.4	Very high	90 Å²	90	54.1 Å²	54.1	34%	0.341	29%	0.293	S	S	.	.			trans	-127.9	-21.8	-175.8	64.3	-99.2	0	0	0	113.5	E49 P103 P107 Y127 V128 P130	E49-W105 WeakPolarHBondContact OE1-CH2 3.48Å; P103-W105 VanDerWaalsContact O-CD1 3.29Å; P103-W105 PolarHBondContact O-N 2.65Å; P103-W105 VanDerWaalsContact O-N 3.07Å; W105-P107 VanDerWaalsContact O-CD 3.31Å; W105-P107 WeakPolarHBondContact O-CD 3.48Å; W105-Y127 WeakPolarHBondContact O-CD1 3.14Å; W105-V128 PolarHBondContact N-O 3.37Å; W105-P130 HydrophobicContact CH2-CG 4.5Å; W105-P130 HydrophobicContact CZ2-CG 3.75Å
106	L	96.5	Very high	95.3	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	116.6	-178.5	-178.8	70.9	0	0	0	110.4	A43 R46 E49 F74 Y127 V128	A43-L106 HydrophobicContact CB-CD1 4.21Å; R46-L106 HydrophobicContact CB-CD1 4.25Å; R46-L106 HydrophobicContact CG-CD1 4.41Å; E49-L106 WeakPolarHBondContact OE2-CD2 3.27Å; F74-L106 HydrophobicContact CE1-CD2 4.01Å; L106-Y127 CarbonylContact O-C 3.59Å; L106-Y127 VanDerWaalsContact O-CA 3.31Å; L106-Y127 WeakPolarHBondContact O-CA 3.41Å; L106-V128 HydrophobicContact CB-CG2 4.03Å; L106-V128 VanDerWaalsContact CB-O 3.28Å; L106-V128 WeakPolarHBondContact CB-O 2.73Å; L106-V128 HydrophobicContact CD2-CG2 4.02Å; L106-V128 HydrophobicContact CG-CG2 4.32Å; L106-V128 PolarHBondContact N-O 3.07Å; L106-V128 PolarHBondContact O-N 2.87Å
107	P	96.9	Very high	95.2	Very high	13 Å²	13	71.3 Å²	71.3	8%	0.084	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	138.6	-176.1	27.6	-33.8	0	0	0	113.1	R41 A43 W105 I124 Y127	R41-P107 WeakPolarHBondContact O-CG 3.36Å; A43-P107 HydrophobicContact CB-CG 3.74Å; W105-P107 VanDerWaalsContact O-CD 3.31Å; W105-P107 WeakPolarHBondContact O-CD 3.48Å; P107-I124 HydrophobicContact CB-CD1 3.72Å; P107-I124 HydrophobicContact CB-CG1 3.96Å; P107-I124 HydrophobicContact CB-CG2 3.76Å; P107-Y127 HydrophobicContact CB-CD1 3.96Å; P107-Y127 HydrophobicContact CB-CE1 3.69Å; P107-Y127 HydrophobicContact CG-CE1 4.42Å
108	R	96.1	Very high	95	Very high	37 Å²	37	73.7 Å²	73.7	14%	0.14	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	119.1	173.5	-65.3	-59.6	-173.5	-152.1	7.9	110.7	K45 H125 H126 V128	K45-R108 PolarHBondContact O-NH1 3.41Å; K45-R108 PolarHBondContact O-NH2 3.47Å; K45-R108 VanDerWaalsContact O-NH2 3.09Å; R108-H125 PolarHBondContact O-N 3.4Å; R108-H126 WeakPolarHBondContact CB-O 3.18Å; R108-H126 PolarHBondContact N-O 3.45Å; R108-H126 PolarHBondContact O-N 2.84Å; R108-V128 HydrophobicContact CG-CG1 4.02Å; R108-V128 HydrophobicContact CG-CG2 3.98Å
109	T	95.3	Very high	94.7	Very high	51 Å²	51	75.3 Å²	75.3	31%	0.313	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	140.4	174.7	57.1	0	0	0	0	110.3	K121 R122 I124	T109-K121 HydrophobicContact CG2-CD 4.32Å; T109-K121 HydrophobicContact CG2-CG 4.04Å; T109-K121 VanDerWaalsContact OG1-CE 3.24Å; T109-K121 WeakPolarHBondContact OG1-CE 3.43Å; T109-R122 VanDerWaalsContact CG2-O 3.32Å; T109-R122 WeakPolarHBondContact CG2-O 3.29Å; T109-I124 HydrophobicContact CG2-CG1 4.27Å
110	K	93.3	Very high	94.4	Very high	136 Å²	136	76.7 Å²	76.7	59%	0.591	45%	0.45	S	S	*	.			trans	-127.6	138.5	176.6	-170.7	-178.9	176	-176.9	0	109.3	H125	K110-H125 HydrophobicContact CB-CB 3.93Å
111	V	93.3	Very high	94	Very high	73 Å²	73	79.6 Å²	79.6	44%	0.442	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-78.9	131.6	170.4	-178.4	0	0	0	0	108.1	M115	V111-M115 HydrophobicContact CG1-CB 3.95Å
112	P	92.6	Very high	93.6	Very high	69 Å²	69	82.7 Å²	82.7	45%	0.448	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-56.9	149	174.9	-24.7	34.3	0	0	0	112.2	G114 M115	P112-G114 PolarHBondContact O-N 2.87Å; P112-M115 HydrophobicContact CB-CG 4.4Å; P112-M115 HydrophobicContact CB-SD 4.43Å; P112-M115 HydrophobicContact CG-SD 4.19Å; P112-M115 PolarHBondContact O-N 3.33Å
113	Q	93.7	Very high	93.4	Very high	202 Å²	202	82.7 Å²	82.7	94%	0.944	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	134.5	177.9	-172.4	171	-6.1	0	0	110.3
114	G	93.7	Very high	93.3	Very high	83 Å²	83	81.5 Å²	81.5	86%	0.856	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	-6.7	178.9	0	0	0	0	0	115.9	P112	P112-G114 PolarHBondContact O-N 2.87Å
115	M	92.1	Very high	93.2	Very high	114 Å²	114	86.8 Å²	86.8	56%	0.562	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-83.8	146.2	175.7	-71.4	-160.2	153.7	0	0	112.9	V111 P112	V111-M115 HydrophobicContact CG1-CB 3.95Å; P112-M115 HydrophobicContact CB-CG 4.4Å; P112-M115 HydrophobicContact CB-SD 4.43Å; P112-M115 HydrophobicContact CG-SD 4.19Å; P112-M115 PolarHBondContact O-N 3.33Å
116	K	93.1	Very high	93.2	Very high	188 Å²	188	84.8 Å²	84.8	82%	0.817	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-71.2	156.5	171.9	-65.3	-176.8	179.9	179.6	0	111.1
117	L	93.5	Very high	93.2	Very high	173 Å²	173	85.5 Å²	85.5	91%	0.906	49%	0.493	S	S	*	.	S	Bend	trans	-64.4	144.1	171.9	-62	176.4	0	0	0	110.4
118	G	91.3	Very high	93.3	Very high	53 Å²	53	85 Å²	85	55%	0.546	49%	0.49	S	S	.	.			trans	109	-174.3	179.7	0	0	0	0	0	114.5	R122	G118-R122 PolarHBondContact O-NH2 3.48Å
119	G	89.5	Confident	93.3	Very high	71 Å²	71	83.3 Å²	83.3	73%	0.732	48%	0.484	S	S	*	.	S	Bend	trans	76.1	20.2	-178.1	0	0	0	0	0	114.8	R122	G119-R122 PolarHBondContact O-NH1 3.4Å
120	G	90.4	Very high	93.4	Very high	64 Å²	64	81.9 Å²	81.9	66%	0.66	48%	0.475	S	S	*	.	S	Bend	trans	78.8	-172.5	177.6	0	0	0	0	0	114.7	R122	G120-R122 PolarHBondContact O-NH1 3.32Å
121	K	89.5	Confident	93.6	Very high	86 Å²	86	75.5 Å²	75.5	37%	0.374	45%	0.448	S	S	.	.			trans	-82.8	136.5	-175.6	-160.5	164.7	-178.6	-179	0	111	Y42 A43 T109	Y42-K121 HydrophobicContact CD2-CD 3.58Å; Y42-K121 HydrophobicContact CE2-CD 4.28Å; Y42-K121 HydrophobicContact CG-CD 3.71Å; Y42-K121 HydrophobicContact CG-CG 4.47Å; A43-K121 PolarHBondContact O-NZ 3.06Å; T109-K121 HydrophobicContact CG2-CD 4.32Å; T109-K121 HydrophobicContact CG2-CG 4.04Å; T109-K121 VanDerWaalsContact OG1-CE 3.24Å; T109-K121 WeakPolarHBondContact OG1-CE 3.43Å
122	R	88.9	Confident	93.8	Very high	76 Å²	76	75.3 Å²	75.3	29%	0.287	44%	0.439	S	S	.	.			trans	-87.3	177.5	-178.9	-62.5	-71.6	178.1	-87.6	-10.1	111.5	T109 G118 G119 G120	T109-R122 VanDerWaalsContact CG2-O 3.32Å; T109-R122 WeakPolarHBondContact CG2-O 3.29Å; G118-R122 PolarHBondContact O-NH2 3.48Å; G119-R122 PolarHBondContact O-NH1 3.4Å; G120-R122 PolarHBondContact O-NH1 3.32Å
123	S	92.1	Very high	94.1	Very high	98 Å²	98	72.2 Å²	72.2	69%	0.685	42%	0.419	S	S	*	.			trans	-58.7	158.4	176	51.6	0	0	0	0	112.9
124	I	94.7	Very high	94.2	Very high	34 Å²	34	63.4 Å²	63.4	17%	0.174	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	129.5	177.5	-59.3	167.9	0	0	0	108.3	E40 P107 T109 Y127	E40-I124 HydrophobicContact CB-CD1 3.95Å; P107-I124 HydrophobicContact CB-CD1 3.72Å; P107-I124 HydrophobicContact CB-CG1 3.96Å; P107-I124 HydrophobicContact CB-CG2 3.76Å; T109-I124 HydrophobicContact CG2-CG1 4.27Å; I124-Y127 HydrophobicContact CG2-CE1 4.38Å; I124-Y127 HydrophobicContact CG2-CE2 4.08Å
125	H	94.7	Very high	94.4	Very high	112 Å²	112	60.6 Å²	60.6	52%	0.519	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-41.2	178.8	-179.5	-70.1	0	0	0	111.9	R108 K110	R108-H125 PolarHBondContact O-N 3.4Å; K110-H125 HydrophobicContact CB-CB 3.93Å
126	H	96	Very high	94.7	Very high	47 Å²	47	55.2 Å²	55.2	22%	0.218	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	167.3	179.1	62.9	-79.7	0	0	0	110.7	H76 R108	H76-H126 AromaticContact CE1-CD2 3.62Å; H76-H126 AromaticContact CE1-CE1 3.98Å; H76-H126 AromaticContact CE1-NE2 3.07Å; H76-H126 PolarHBondContact CE1-NE2 3.05Å; H76-H126 AromaticContact ND1-CD2 3.38Å; H76-H126 PolarHBondContact ND1-CD2 3.05Å; H76-H126 AromaticContact ND1-NE2 3.37Å; H76-H126 PolarHBondContact ND1-NE2 2.93Å; R108-H126 WeakPolarHBondContact CB-O 3.18Å; R108-H126 PolarHBondContact N-O 3.45Å; R108-H126 PolarHBondContact O-N 2.84Å
127	Y	97.2	Very high	94.9	Very high	16 Å²	16	46.2 Å²	46.2	6%	0.063	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	152.5	171.9	-62.8	-92.8	0	0	0	110.3	A29 P30 F32 E40 W105 L106 P107 I124	A29-Y127 HydrophobicContact CB-CD2 3.63Å; A29-Y127 HydrophobicContact CB-CE2 3.58Å; P30-Y127 HydrophobicContact CG-CD1 4.1Å; P30-Y127 HydrophobicContact CG-CE1 3.82Å; F32-Y127 HydrophobicContact CZ-CE1 4.49Å; F32-Y127 WeakPolarHBondContact CZ-OH 3.5Å; E40-Y127 VanDerWaalsContact CD-OH 3.26Å; E40-Y127 PolarHBondContact OE1-OH 2.91Å; W105-Y127 WeakPolarHBondContact O-CD1 3.14Å; L106-Y127 CarbonylContact O-C 3.59Å; L106-Y127 VanDerWaalsContact O-CA 3.31Å; L106-Y127 WeakPolarHBondContact O-CA 3.41Å; P107-Y127 HydrophobicContact CB-CD1 3.96Å; P107-Y127 HydrophobicContact CB-CE1 3.69Å; P107-Y127 HydrophobicContact CG-CE1 4.42Å; I124-Y127 HydrophobicContact CG2-CE1 4.38Å; I124-Y127 HydrophobicContact CG2-CE2 4.08Å
128	V	97.4	Very high	95.1	Very high	1 Å²	1	38 Å²	38	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.6	174.8	-60.7	0	0	0	0	110.7	F74 L75 W105 L106 R108	F74-V128 HydrophobicContact CB-CB 4.15Å; F74-V128 HydrophobicContact CB-CG1 4.42Å; F74-V128 HydrophobicContact CB-CG2 4.21Å; F74-V128 HydrophobicContact CD1-CB 4.44Å; F74-V128 HydrophobicContact CD1-CG2 3.69Å; F74-V128 HydrophobicContact CE1-CG2 4.48Å; F74-V128 HydrophobicContact CG-CG2 4.19Å; L75-V128 CarbonylContact O-C 3.55Å; L75-V128 VanDerWaalsContact O-CA 3.23Å; L75-V128 WeakPolarHBondContact O-CA 3.24Å; L75-V128 WeakPolarHBondContact O-CB 3.33Å; W105-V128 PolarHBondContact N-O 3.37Å; L106-V128 HydrophobicContact CB-CG2 4.03Å; L106-V128 VanDerWaalsContact CB-O 3.28Å; L106-V128 WeakPolarHBondContact CB-O 2.73Å; L106-V128 HydrophobicContact CD2-CG2 4.02Å; L106-V128 HydrophobicContact CG-CG2 4.32Å; L106-V128 PolarHBondContact N-O 3.07Å; L106-V128 PolarHBondContact O-N 2.87Å; R108-V128 HydrophobicContact CG-CG1 4.02Å; R108-V128 HydrophobicContact CG-CG2 3.98Å
129	T	97.5	Very high	95.3	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120	166.9	-48.1	0	0	0	0	109.3	L75 V101 D102 P103 P104	L75-T129 PolarHBondContact N-O 2.79Å; L75-T129 PolarHBondContact O-N 3.26Å; V101-T129 HydrophobicContact CG1-CG2 3.4Å; D102-T129 WeakPolarHBondContact O-CG2 3.23Å; D102-T129 PolarHBondContact O-OG1 3.49Å; P103-T129 VanDerWaalsContact C-OG1 3.29Å; P103-T129 PolarHBondContact O-OG1 2.66Å; P104-T129 VanDerWaalsContact CA-OG1 3.27Å; P104-T129 WeakPolarHBondContact CA-OG1 3.41Å
130	P	97.6	Very high	95.6	Very high	21 Å²	21	32.1 Å²	32.1	14%	0.136	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	138.3	171	31.1	-35.3	0	0	0	110.4	E49 I50 F74 W105	E49-P130 HydrophobicContact CB-CB 3.51Å; E49-P130 HydrophobicContact CB-CG 3.85Å; E49-P130 WeakPolarHBondContact OE2-CG 3.26Å; I50-P130 HydrophobicContact CG2-CB 3.97Å; F74-P130 HydrophobicContact CD1-CB 4.17Å; F74-P130 HydrophobicContact CE1-CB 3.95Å; W105-P130 HydrophobicContact CH2-CG 4.5Å; W105-P130 HydrophobicContact CZ2-CG 3.75Å
131	V	97.7	Very high	95.8	Very high	2 Å²	2	29 Å²	29	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136	175.6	178.3	0	0	0	0	108.6	A69 G72 G73 L75 V101 R135 I137 M162	A69-V131 HydrophobicContact CB-CG1 3.83Å; G72-V131 CarbonylContact C-O 3.53Å; G72-V131 WeakPolarHBondContact CA-O 3.45Å; G73-V131 PolarHBondContact N-O 2.78Å; G73-V131 PolarHBondContact O-N 2.77Å; L75-V131 HydrophobicContact CD1-CG2 3.64Å; L75-V131 HydrophobicContact CG-CG2 3.76Å; V101-V131 HydrophobicContact CG1-CG2 4.24Å; V101-V131 HydrophobicContact CG2-CG2 4.46Å; V131-R135 HydrophobicContact CG1-CB 3.66Å; V131-R135 HydrophobicContact CG1-CG 3.82Å; V131-I137 HydrophobicContact CG1-CG1 4.46Å; V131-M162 HydrophobicContact CB-CE 3.71Å; V131-M162 HydrophobicContact CB-SD 4.22Å; V131-M162 HydrophobicContact CG1-CE 3.53Å; V131-M162 HydrophobicContact CG1-SD 4.36Å; V131-M162 HydrophobicContact CG2-CE 4.15Å
132	R	97.4	Very high	96	Very high	69 Å²	69	25 Å²	25	26%	0.26	13%	0.128	S	C	.	.			trans	-96.7	163.6	175.6	-68.1	-174.8	170.8	-177.1	-7.3	111.9	I48 E49 P53 E54 G134 R135	I48-R132 PolarHBondContact O-NH2 3.13Å; I48-R132 VanDerWaalsContact O-NH2 3.12Å; E49-R132 WeakPolarHBondContact O-CG 3.27Å; E49-R132 PolarHBondContact O-NE 3.14Å; P53-R132 WeakPolarHBondContact O-CD 3.35Å; E54-R132 HydrophobicContact CB-CB 3.98Å; R132-G134 PolarHBondContact O-N 3Å; R132-R135 VanDerWaalsContact O-CB 3.27Å; R132-R135 WeakPolarHBondContact O-CB 3.41Å; R132-R135 PolarHBondContact O-N 3.46Å
133	A	97.3	Very high	96.2	Very high	4 Å²	4	24.5 Å²	24.5	3%	0.033	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-62	134.2	175	0	0	0	0	0	111	G52 P53 E54 K70 R135 Y218	G52-A133 PolarHBondContact O-N 2.94Å; P53-A133 CarbonylContact C-O 3.47Å; E54-A133 WeakPolarHBondContact CB-O 3.3Å; E54-A133 PolarHBondContact N-O 3.02Å; K70-A133 WeakPolarHBondContact O-CB 3.4Å; A133-R135 VanDerWaalsContact C-N 3.35Å; A133-Y218 HydrophobicContact CB-CD1 3.93Å; A133-Y218 HydrophobicContact CB-CE1 3.57Å
134	G	96.7	Very high	96.3	Very high	17 Å²	17	20.1 Å²	20.1	18%	0.175	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	-6.5	-176.6	0	0	0	0	0	115	T58 A69 R132 I136	T58-G134 WeakPolarHBondContact CG2-O 3.33Å; A69-G134 WeakPolarHBondContact O-CA 3.47Å; A69-G134 PolarHBondContact O-N 3.1Å; R132-G134 PolarHBondContact O-N 3Å; G134-I136 PolarHBondContact O-N 3.21Å
135	R	97.6	Very high	96.2	Very high	24 Å²	24	20.4 Å²	20.4	9%	0.091	10%	0.101	C	C	.	.			trans	-68.5	132.2	178.1	178.5	61	178	-132.2	9.1	111.3	E54 H57 A69 R100 V101 V131 R132 A133	E54-R135 HydrophobicContact CB-CB 3.99Å; E54-R135 HydrophobicContact CG-CB 3.86Å; E54-R135 HydrophobicContact CG-CG 4.39Å; E54-R135 IonicContact OE1-CZ 3.64Å; E54-R135 IonicContact OE1-NH1 3.07Å; E54-R135 PolarHBondContact OE1-NH1 3.3Å; H57-R135 PolarHBondContact CD2-NH1 3.15Å; H57-R135 PolarHBondContact CD2-NH2 3.29Å; H57-R135 VanDerWaalsContact CD2-NH2 3.31Å; H57-R135 VanDerWaalsContact CG-NH2 3.29Å; H57-R135 PolarHBondContact NE2-NH2 3.09Å; A69-R135 PolarHBondContact N-O 2.93Å; R100-R135 PolarHBondContact O-NE 3Å; R100-R135 PolarHBondContact O-NH2 3.44Å; V101-R135 HydrophobicContact CG2-CG 4.1Å; V131-R135 HydrophobicContact CG1-CB 3.66Å; V131-R135 HydrophobicContact CG1-CG 3.82Å; R132-R135 VanDerWaalsContact O-CB 3.27Å; R132-R135 WeakPolarHBondContact O-CB 3.41Å; R132-R135 PolarHBondContact O-N 3.46Å; A133-R135 VanDerWaalsContact C-N 3.35Å
136	I	97.9	Very high	96.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.7	168.2	-55.4	-174.6	0	0	0	109.1	H57 T58 K59 L60 L67 R100 G134 V138	H57-I136 PolarHBondContact O-N 2.89Å; H57-I136 VanDerWaalsContact O-N 3.09Å; T58-I136 WeakPolarHBondContact O-CD1 3.48Å; K59-I136 VanDerWaalsContact C-CD1 3.49Å; L60-I136 HydrophobicContact CD2-CD1 3.56Å; L60-I136 HydrophobicContact CD2-CG2 4.39Å; L60-I136 HydrophobicContact CG-CD1 3.87Å; L67-I136 WeakPolarHBondContact O-CA 3.35Å; R100-I136 HydrophobicContact CB-CG2 4.35Å; R100-I136 WeakPolarHBondContact CB-O 3.29Å; R100-I136 HydrophobicContact CG-CG2 4.17Å; G134-I136 PolarHBondContact O-N 3.21Å; I136-V138 WeakPolarHBondContact CG2-O 3.38Å
137	I	97.6	Very high	96.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-50.3	-176.7	-55.4	170.9	0	0	0	110.9	L67 A69 L75 W99 R100 V101 V131 L160 M162	L67-I137 PolarHBondContact O-N 2.91Å; A69-I137 HydrophobicContact CB-CD1 4.22Å; L75-I137 HydrophobicContact CD1-CG2 4.05Å; W99-I137 HydrophobicContact CZ3-CG2 4.42Å; R100-I137 PolarHBondContact N-O 3.42Å; V101-I137 HydrophobicContact CG2-CB 4.35Å; V101-I137 HydrophobicContact CG2-CG1 4.44Å; V101-I137 HydrophobicContact CG2-CG2 4.26Å; V131-I137 HydrophobicContact CG1-CG1 4.46Å; I137-L160 HydrophobicContact CD1-CD1 3.45Å; I137-L160 VanDerWaalsContact CD1-CD1 3.45Å; I137-L160 HydrophobicContact CD1-CD2 4.2Å; I137-M162 HydrophobicContact CD1-CE 3.46Å; I137-M162 VanDerWaalsContact CD1-CE 3.46Å; I137-M162 HydrophobicContact CG1-CE 4.39Å
138	V	97.5	Very high	95.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	138.8	179	178.6	0	0	0	0	107.9	L23 G66 L67 I83 I98 W99 I136	L23-V138 HydrophobicContact CD1-CG1 4.37Å; L23-V138 HydrophobicContact CD2-CG1 4.27Å; G66-V138 CarbonylContact C-O 3.51Å; G66-V138 VanDerWaalsContact CA-O 3.23Å; G66-V138 WeakPolarHBondContact CA-O 3.27Å; L67-V138 HydrophobicContact CB-CB 4.15Å; L67-V138 HydrophobicContact CD2-CG2 4.47Å; L67-V138 PolarHBondContact N-O 3.01Å; I83-V138 HydrophobicContact CG2-CG2 3.92Å; I98-V138 WeakPolarHBondContact O-CA 3.47Å; W99-V138 HydrophobicContact CE3-CG2 3.71Å; W99-V138 HydrophobicContact CH2-CG2 4.3Å; W99-V138 HydrophobicContact CZ3-CG2 3.44Å; W99-V138 VanDerWaalsContact CZ3-CG2 3.44Å; I136-V138 WeakPolarHBondContact CG2-O 3.38Å
139	E	96.2	Very high	95.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.4	169.3	-165.4	163.5	-165.3	0	0	109	L60 I61 H62 A97 I98 R100	L60-E139 WeakPolarHBondContact CA-OE1 3.44Å; L60-E139 HydrophobicContact CD2-CG 4.04Å; I61-E139 PolarHBondContact N-OE1 3.03Å; H62-E139 HydrophobicContact CB-CG 4.49Å; H62-E139 IonicContact CE1-OE2 3.69Å; H62-E139 IonicContact CG-OE1 2.72Å; H62-E139 PolarHBondContact N-OE1 2.72Å; H62-E139 IonicContact ND1-OE1 3.67Å; H62-E139 PolarHBondContact ND1-OE1 2.67Å; H62-E139 IonicContact ND1-OE2 3.3Å; H62-E139 PolarHBondContact ND1-OE2 3.19Å; A97-E139 CarbonylContact C-O 3.56Å; A97-E139 VanDerWaalsContact CA-O 3.3Å; A97-E139 WeakPolarHBondContact CA-O 3.43Å; I98-E139 PolarHBondContact N-O 3.32Å; I98-E139 PolarHBondContact O-N 3.26Å; R100-E139 WeakPolarHBondContact CD-OE2 3.33Å; R100-E139 HydrophobicContact CG-CB 3.84Å; R100-E139 IonicContact CZ-OE2 2.93Å; R100-E139 IonicContact NE-OE2 2.7Å; R100-E139 IonicContact NH1-OE1 3.13Å; R100-E139 IonicContact NH1-OE2 3.73Å; R100-E139 PolarHBondContact NH1-OE2 3.34Å
140	L	96.2	Very high	95.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131	-178.7	-179.1	74.6	0	0	0	108.2	Y65 L91 F96 A97 V144 A149 M152 L153	Y65-L140 PolarHBondContact N-O 2.99Å; Y65-L140 PolarHBondContact O-N 2.88Å; L91-L140 HydrophobicContact CD1-CD1 3.48Å; L91-L140 VanDerWaalsContact CD1-CD1 3.48Å; F96-L140 WeakPolarHBondContact O-CA 3.29Å; F96-L140 WeakPolarHBondContact O-CD1 3.35Å; A97-L140 HydrophobicContact CB-CD1 4.09Å; L140-V144 HydrophobicContact CD2-CG1 4.18Å; L140-A149 HydrophobicContact CD2-CB 3.81Å; L140-M152 HydrophobicContact CD1-CE 4.05Å; L140-M152 HydrophobicContact CD2-SD 4.44Å; L140-L153 HydrophobicContact CB-CD1 4.3Å; L140-L153 HydrophobicContact CB-CD2 4.35Å; L140-L153 HydrophobicContact CD2-CD1 4.14Å; L140-L153 HydrophobicContact CD2-CD2 4.37Å; L140-L153 HydrophobicContact CD2-CG 4.1Å
141	G	95	Very high	95.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	-172.4	177.7	0	0	0	0	0	113.7	A95 F96	A95-G141 CarbonylContact C-O 3.5Å; A95-G141 VanDerWaalsContact CA-O 3.3Å; A95-G141 WeakPolarHBondContact CA-O 3.34Å; F96-G141 VanDerWaalsContact CD1-C 3.5Å; F96-G141 PolarHBondContact N-O 3.21Å; F96-G141 PolarHBondContact O-N 3.46Å
142	G	93.6	Very high	95.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.4	-154.5	-169.8	0	0	0	0	0	113.9	Q64 K94 F96 V144	Q64-G142 PolarHBondContact NE2-O 2.76Å; Q64-G142 PolarHBondContact OE1-O 2.73Å; K94-G142 VanDerWaalsContact O-CA 3.3Å; K94-G142 WeakPolarHBondContact O-CA 3.15Å; F96-G142 VanDerWaalsContact CE1-N 3.3Å; G142-V144 PolarHBondContact O-N 3.4Å
143	H	92.4	Very high	95.4	Very high	67 Å²	67	30 Å²	30	31%	0.31	15%	0.151	S	C	.	.	S	Bend	trans	-84.5	67	176.3	-61.1	72.3	0	0	0	109.6	F10 K94	F10-H143 HydrophobicContact CD1-CB 4.15Å; F10-H143 HydrophobicContact CD2-CB 4.03Å; F10-H143 AromaticContact CD2-CD2 3.53Å; F10-H143 HydrophobicContact CE1-CB 4.17Å; F10-H143 HydrophobicContact CE2-CB 4.04Å; F10-H143 HydrophobicContact CG-CB 4.07Å; F10-H143 AromaticContact CG-CD2 3.68Å; F10-H143 HydrophobicContact CZ-CB 4.11Å; K94-H143 HydrophobicContact CB-CB 4.02Å; K94-H143 PolarHBondContact O-N 3.17Å; K94-H143 VanDerWaalsContact O-N 3.08Å; K94-H143 PolarHBondContact O-ND1 2.78Å
144	V	93.1	Very high	95.4	Very high	6 Å²	6	32.1 Å²	32.1	4%	0.036	17%	0.165	C	C	.	.			trans	-116.2	128.2	-174.7	-177.1	0	0	0	0	109.7	Y65 A95 L140 G142 Q148 A149	Y65-V144 HydrophobicContact CE2-CB 4.36Å; Y65-V144 PolarHBondContact OH-O 3.23Å; A95-V144 HydrophobicContact CB-CG2 3.4Å; L140-V144 HydrophobicContact CD2-CG1 4.18Å; G142-V144 PolarHBondContact O-N 3.4Å; V144-Q148 HydrophobicContact CG1-CB 3.92Å; V144-A149 HydrophobicContact CG1-CB 3.93Å
145	T	93.3	Very high	95.3	Very high	39 Å²	39	34.2 Å²	34.2	24%	0.239	17%	0.173	C	C	.	.			trans	-76.9	155	174.6	73.5	0	0	0	0	110.9	L8 F10 D147 Q148 A149	L8-T145 HydrophobicContact CD2-CG2 3.5Å; L8-T145 VanDerWaalsContact CD2-CG2 3.5Å; F10-T145 HydrophobicContact CE1-CG2 4.39Å; F10-T145 HydrophobicContact CZ-CG2 4.23Å; T145-D147 VanDerWaalsContact C-N 3.26Å; T145-D147 PolarHBondContact O-N 3.48Å; T145-Q148 VanDerWaalsContact N-OE1 3.13Å; T145-Q148 PolarHBondContact O-N 2.87Å; T145-Q148 VanDerWaalsContact O-N 3.17Å; T145-Q148 VanDerWaalsContact OG1-CG 3.3Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.39Å; T145-Q148 PolarHBondContact OG1-N 2.8Å; T145-Q148 PolarHBondContact OG1-OE1 2.9Å; T145-A149 PolarHBondContact O-N 2.82Å
146	V	93.8	Very high	95.2	Very high	87 Å²	87	33.1 Å²	33.1	53%	0.527	17%	0.169	S	C	.	.	H	α-helix	trans	-57.7	-40.2	180	-177.5	0	0	0	0	111.4	Y65 A149 L150 M166	Y65-V146 HydrophobicContact CE1-CG2 4.13Å; Y65-V146 VanDerWaalsContact OH-CG2 3.27Å; Y65-V146 WeakPolarHBondContact OH-CG2 3.09Å; V146-A149 PolarHBondContact O-N 3.41Å; V146-L150 VanDerWaalsContact O-CB 3.29Å; V146-L150 WeakPolarHBondContact O-CB 3.37Å; V146-L150 PolarHBondContact O-N 2.84Å; V146-M166 HydrophobicContact CG1-CE 4.11Å
147	D	94.1	Very high	95.1	Very high	74 Å²	74	33.7 Å²	33.7	40%	0.396	17%	0.173	S	C	.	.	H	α-helix	trans	-66.3	-40.2	178.2	170.9	77.2	0	0	0	112.4	T145 L150 R151	T145-D147 VanDerWaalsContact C-N 3.26Å; T145-D147 PolarHBondContact O-N 3.48Å; D147-L150 PolarHBondContact O-N 2.9Å; D147-R151 VanDerWaalsContact CG-NH2 3.28Å; D147-R151 WeakPolarHBondContact O-CG 3.34Å; D147-R151 PolarHBondContact O-N 3.11Å; D147-R151 IonicContact OD1-CZ 3.28Å; D147-R151 IonicContact OD1-NE 3.74Å; D147-R151 PolarHBondContact OD1-NE 3.18Å; D147-R151 VanDerWaalsContact OD1-NE 3.13Å; D147-R151 IonicContact OD1-NH2 2.65Å; D147-R151 PolarHBondContact OD1-NH2 3.42Å; D147-R151 IonicContact OD2-CZ 3.26Å; D147-R151 IonicContact OD2-NE 3.95Å; D147-R151 PolarHBondContact OD2-NE 3.43Å; D147-R151 VanDerWaalsContact OD2-NE 3.14Å; D147-R151 IonicContact OD2-NH1 2.72Å; D147-R151 IonicContact OD2-NH2 3.9Å; D147-R151 PolarHBondContact OD2-NH2 2.94Å
148	Q	93.7	Very high	95	Very high	71 Å²	71	40.1 Å²	40.1	33%	0.332	21%	0.208	S	C	.	.	H	α-helix	trans	-62.3	-49	173.4	-75.7	173.5	-24.3	0	0	111	V144 T145 L150 R151 M152	V144-Q148 HydrophobicContact CG1-CB 3.92Å; T145-Q148 VanDerWaalsContact N-OE1 3.13Å; T145-Q148 PolarHBondContact O-N 2.87Å; T145-Q148 VanDerWaalsContact O-N 3.17Å; T145-Q148 VanDerWaalsContact OG1-CG 3.3Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.39Å; T145-Q148 PolarHBondContact OG1-N 2.8Å; T145-Q148 PolarHBondContact OG1-OE1 2.9Å; Q148-L150 VanDerWaalsContact C-N 3.31Å; Q148-L150 PolarHBondContact O-N 2.86Å; Q148-R151 PolarHBondContact O-N 3.46Å; Q148-M152 VanDerWaalsContact O-CG 3.29Å; Q148-M152 WeakPolarHBondContact O-CG 3.35Å; Q148-M152 PolarHBondContact O-N 3.4Å
149	A	95.4	Very high	94.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-44.2	177.2	0	0	0	0	0	111.5	Y65 L140 V144 T145 V146 R151 M152 L153 M166	Y65-A149 HydrophobicContact CD1-CB 4.15Å; Y65-A149 HydrophobicContact CD2-CB 3.79Å; Y65-A149 HydrophobicContact CE1-CB 4.4Å; Y65-A149 HydrophobicContact CE2-CB 4.06Å; Y65-A149 HydrophobicContact CG-CB 3.84Å; L140-A149 HydrophobicContact CD2-CB 3.81Å; V144-A149 HydrophobicContact CG1-CB 3.93Å; T145-A149 PolarHBondContact O-N 2.82Å; V146-A149 PolarHBondContact O-N 3.41Å; A149-R151 PolarHBondContact O-N 3.35Å; A149-M152 PolarHBondContact O-N 2.76Å; A149-L153 VanDerWaalsContact O-CB 3.32Å; A149-L153 WeakPolarHBondContact O-CB 3.17Å; A149-L153 WeakPolarHBondContact O-CG 3.49Å; A149-L153 PolarHBondContact O-N 2.84Å; A149-M166 HydrophobicContact CB-SD 4Å
150	L	95.6	Very high	94.8	Very high	81 Å²	81	43.6 Å²	43.6	42%	0.424	23%	0.228	S	C	.	.	H	α-helix	trans	-59.2	-49.9	178.7	-173.2	71.9	0	0	0	111.2	V146 D147 Q148 M152 C154 M166	V146-L150 VanDerWaalsContact O-CB 3.29Å; V146-L150 WeakPolarHBondContact O-CB 3.37Å; V146-L150 PolarHBondContact O-N 2.84Å; D147-L150 PolarHBondContact O-N 2.9Å; Q148-L150 VanDerWaalsContact C-N 3.31Å; Q148-L150 PolarHBondContact O-N 2.86Å; L150-M152 VanDerWaalsContact C-N 3.35Å; L150-M152 PolarHBondContact O-N 3.31Å; L150-C154 VanDerWaalsContact CD1-SG 3.59Å; L150-C154 WeakPolarHBondContact O-CB 3.16Å; L150-C154 PolarHBondContact O-N 3.3Å; L150-C154 PolarHBondContact O-SG 2.8Å; L150-M166 WeakPolarHBondContact CA-SD 3.16Å; L150-M166 HydrophobicContact CB-SD 4.07Å; L150-M166 HydrophobicContact CD1-CE 4.44Å; L150-M166 HydrophobicContact CD1-SD 4.09Å; L150-M166 PolarHBondContact N-SD 3.42Å; L150-M166 VanDerWaalsContact N-SD 3.45Å
151	R	95.1	Very high	94.8	Very high	153 Å²	153	47.2 Å²	47.2	58%	0.577	25%	0.252	S	S	*	.	H	α-helix	trans	-62.2	-42.5	179.7	-68.5	174.7	-164.4	-179.1	4.3	112	D147 Q148 A149 N155	D147-R151 VanDerWaalsContact CG-NH2 3.28Å; D147-R151 WeakPolarHBondContact O-CG 3.34Å; D147-R151 PolarHBondContact O-N 3.11Å; D147-R151 IonicContact OD1-CZ 3.28Å; D147-R151 IonicContact OD1-NE 3.74Å; D147-R151 PolarHBondContact OD1-NE 3.18Å; D147-R151 VanDerWaalsContact OD1-NE 3.13Å; D147-R151 IonicContact OD1-NH2 2.65Å; D147-R151 PolarHBondContact OD1-NH2 3.42Å; D147-R151 IonicContact OD2-CZ 3.26Å; D147-R151 IonicContact OD2-NE 3.95Å; D147-R151 PolarHBondContact OD2-NE 3.43Å; D147-R151 VanDerWaalsContact OD2-NE 3.14Å; D147-R151 IonicContact OD2-NH1 2.72Å; D147-R151 IonicContact OD2-NH2 3.9Å; D147-R151 PolarHBondContact OD2-NH2 2.94Å; Q148-R151 PolarHBondContact O-N 3.46Å; A149-R151 PolarHBondContact O-N 3.35Å; R151-N155 WeakPolarHBondContact O-CB 3.25Å; R151-N155 PolarHBondContact O-N 3.25Å; R151-N155 PolarHBondContact O-ND2 3.12Å
152	M	95.5	Very high	94.8	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.03	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-49.3	-178.9	-67.8	173.1	68.4	0	0	111.6	V87 R90 L91 L140 Q148 A149 L150 A156	V87-M152 HydrophobicContact CG1-CE 3.79Å; V87-M152 WeakPolarHBondContact O-CE 3.36Å; R90-M152 HydrophobicContact CB-CE 4.05Å; R90-M152 HydrophobicContact CB-CG 3.93Å; R90-M152 HydrophobicContact CB-SD 4.02Å; L91-M152 HydrophobicContact CB-CE 4.25Å; L91-M152 HydrophobicContact CD1-CE 3.78Å; L140-M152 HydrophobicContact CD1-CE 4.05Å; L140-M152 HydrophobicContact CD2-SD 4.44Å; Q148-M152 VanDerWaalsContact O-CG 3.29Å; Q148-M152 WeakPolarHBondContact O-CG 3.35Å; Q148-M152 PolarHBondContact O-N 3.4Å; A149-M152 PolarHBondContact O-N 2.76Å; L150-M152 VanDerWaalsContact C-N 3.35Å; L150-M152 PolarHBondContact O-N 3.31Å; M152-A156 PolarHBondContact O-N 3.25Å; M152-A156 VanDerWaalsContact O-N 3.12Å
153	L	96.3	Very high	94.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-78.1	-33.8	-174	-62.2	178.9	0	0	0	112.6	L67 L140 A149 A156 A157 M166	L67-L153 HydrophobicContact CB-CD2 4.28Å; L140-L153 HydrophobicContact CB-CD1 4.3Å; L140-L153 HydrophobicContact CB-CD2 4.35Å; L140-L153 HydrophobicContact CD2-CD1 4.14Å; L140-L153 HydrophobicContact CD2-CD2 4.37Å; L140-L153 HydrophobicContact CD2-CG 4.1Å; A149-L153 VanDerWaalsContact O-CB 3.32Å; A149-L153 WeakPolarHBondContact O-CB 3.17Å; A149-L153 WeakPolarHBondContact O-CG 3.49Å; A149-L153 PolarHBondContact O-N 2.84Å; L153-A156 PolarHBondContact O-N 3.4Å; L153-A157 WeakPolarHBondContact O-CB 3.35Å; L153-A157 PolarHBondContact O-N 3.08Å; L153-M166 HydrophobicContact CB-CB 4.09Å; L153-M166 HydrophobicContact CB-CG 4.28Å; L153-M166 HydrophobicContact CD1-CB 4.31Å; L153-M166 HydrophobicContact CD1-CG 3.69Å; L153-M166 HydrophobicContact CD1-SD 4.18Å
154	C	95.9	Very high	95.1	Very high	49 Å²	49	48.5 Å²	48.5	33%	0.331	27%	0.267	S	S	.	.	H	α-helix	trans	-64.3	-41.4	172	-73.8	0	0	0	0	111.7	L150 A156 A157 N158	L150-C154 VanDerWaalsContact CD1-SG 3.59Å; L150-C154 WeakPolarHBondContact O-CB 3.16Å; L150-C154 PolarHBondContact O-N 3.3Å; L150-C154 PolarHBondContact O-SG 2.8Å; C154-A156 VanDerWaalsContact C-N 3.3Å; C154-A156 PolarHBondContact O-N 3.14Å; C154-A157 WeakPolarHBondContact O-CB 3.4Å; C154-A157 PolarHBondContact O-N 3.11Å; C154-N158 PolarHBondContact O-N 3.25Å; C154-N158 PolarHBondContact O-ND2 3.01Å
155	N	95.1	Very high	95.3	Very high	62 Å²	62	50.3 Å²	50.3	33%	0.332	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-39.3	174.3	-74.6	-28.4	0	0	0	111.6	S86 R90 R151	S86-N155 WeakPolarHBondContact OG-CB 3.31Å; R90-N155 PolarHBondContact NH1-ND2 2.77Å; R90-N155 PolarHBondContact NH2-ND2 2.95Å; R151-N155 WeakPolarHBondContact O-CB 3.25Å; R151-N155 PolarHBondContact O-N 3.25Å; R151-N155 PolarHBondContact O-ND2 3.12Å
156	A	95.8	Very high	95.5	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-39.3	173.7	0	0	0	0	0	112.4	L67 I83 V87 M152 L153 C154 N158 V159	L67-A156 HydrophobicContact CD2-CB 3.88Å; I83-A156 HydrophobicContact CG1-CB 4.21Å; I83-A156 HydrophobicContact CG2-CB 4.13Å; V87-A156 HydrophobicContact CG2-CB 4.31Å; M152-A156 PolarHBondContact O-N 3.25Å; M152-A156 VanDerWaalsContact O-N 3.12Å; L153-A156 PolarHBondContact O-N 3.4Å; C154-A156 VanDerWaalsContact C-N 3.3Å; C154-A156 PolarHBondContact O-N 3.14Å; A156-N158 PolarHBondContact O-N 3Å; A156-V159 PolarHBondContact O-N 3.13Å
157	A	96.4	Very high	95.7	Very high	12 Å²	12	45.9 Å²	45.9	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-41.5	177.7	0	0	0	0	0	112.3	L67 L153 C154 V159 L160 A164	L67-A157 HydrophobicContact CD1-CB 3.83Å; L153-A157 WeakPolarHBondContact O-CB 3.35Å; L153-A157 PolarHBondContact O-N 3.08Å; C154-A157 WeakPolarHBondContact O-CB 3.4Å; C154-A157 PolarHBondContact O-N 3.11Å; A157-V159 PolarHBondContact O-N 3.11Å; A157-L160 WeakPolarHBondContact O-CB 3.37Å; A157-L160 PolarHBondContact O-N 2.9Å; A157-L160 VanDerWaalsContact O-N 3.12Å; A157-A164 HydrophobicContact CB-CB 4.09Å
158	N	95.5	Very high	95.8	Very high	135 Å²	135	43.1 Å²	43.1	72%	0.722	23%	0.232	S	C	*	.	H	α-helix	trans	-65.5	-21.5	-179.1	-70.9	-24.1	0	0	0	113.9	C154 A156	C154-N158 PolarHBondContact O-N 3.25Å; C154-N158 PolarHBondContact O-ND2 3.01Å; A156-N158 PolarHBondContact O-N 3Å
159	V	94	Very high	95.9	Very high	58 Å²	58	42.2 Å²	42.2	35%	0.352	23%	0.228	S	C	.	.	H	α-helix	trans	-88.3	-14.5	178.3	-173.8	0	0	0	0	112.2	A156 A157	A156-V159 PolarHBondContact O-N 3.13Å; A157-V159 PolarHBondContact O-N 3.11Å
160	L	95.5	Very high	95.9	Very high	15 Å²	15	45.3 Å²	45.3	8%	0.079	25%	0.254	C	S	.	.	S	Bend	trans	-73.3	145.1	-179.4	-74.8	171.6	0	0	0	111.2	L67 L75 I83 I137 A157 M162 A164	L67-L160 HydrophobicContact CD2-CD1 3.76Å; L67-L160 HydrophobicContact CG-CD1 4.28Å; L75-L160 HydrophobicContact CD2-CD2 3.38Å; I83-L160 HydrophobicContact CD1-CD2 3.66Å; I83-L160 HydrophobicContact CD1-CG 4.08Å; I137-L160 HydrophobicContact CD1-CD1 3.45Å; I137-L160 VanDerWaalsContact CD1-CD1 3.45Å; I137-L160 HydrophobicContact CD1-CD2 4.2Å; A157-L160 WeakPolarHBondContact O-CB 3.37Å; A157-L160 PolarHBondContact O-N 2.9Å; A157-L160 VanDerWaalsContact O-N 3.12Å; L160-M162 WeakPolarHBondContact CB-O 3.47Å; L160-M162 PolarHBondContact O-N 3.4Å; L160-A164 HydrophobicContact CD1-CB 3.56Å
161	P	95.4	Very high	95.9	Very high	76 Å²	76	44.2 Å²	44.2	49%	0.494	25%	0.249	S	C	.	.	S	Bend	trans	-72.7	-7.8	177.5	32.3	-37.4	0	0	0	112.8	F74 L75	F74-P161 WeakPolarHBondContact O-CG 3.43Å; L75-P161 HydrophobicContact CD2-CG 4.22Å
162	M	94.7	Very high	96	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.049	23%	0.228	C	C	.	.	S	Bend	trans	-128.7	148.4	-178.5	66.5	-150.9	177	0	0	108.7	A69 G73 L75 V131 I137 L160 A164	A69-M162 HydrophobicContact CB-CE 3.77Å; A69-M162 HydrophobicContact CB-SD 4.48Å; G73-M162 VanDerWaalsContact CA-SD 3.59Å; L75-M162 HydrophobicContact CD2-CE 3.88Å; L75-M162 HydrophobicContact CG-CE 4.39Å; V131-M162 HydrophobicContact CB-CE 3.71Å; V131-M162 HydrophobicContact CB-SD 4.22Å; V131-M162 HydrophobicContact CG1-CE 3.53Å; V131-M162 HydrophobicContact CG1-SD 4.36Å; V131-M162 HydrophobicContact CG2-CE 4.15Å; I137-M162 HydrophobicContact CD1-CE 3.46Å; I137-M162 VanDerWaalsContact CD1-CE 3.46Å; I137-M162 HydrophobicContact CG1-CE 4.39Å; L160-M162 WeakPolarHBondContact CB-O 3.47Å; L160-M162 PolarHBondContact O-N 3.4Å; M162-A164 PolarHBondContact O-N 2.86Å
163	P	96.6	Very high	96	Very high	66 Å²	66	41.6 Å²	41.6	43%	0.429	25%	0.245	S	C	.	.			trans	-60	129.9	176.7	24.6	-33.1	0	0	0	109.7	K70 L71	K70-P163 HydrophobicContact CB-CB 4.28Å; K70-P163 HydrophobicContact CB-CG 4.18Å; K70-P163 WeakPolarHBondContact CB-O 3.32Å; K70-P163 HydrophobicContact CD-CB 4.49Å; K70-P163 PolarHBondContact N-O 2.89Å; L71-P163 HydrophobicContact CB-CG 4.09Å; L71-P163 HydrophobicContact CD1-CG 3.66Å; L71-P163 HydrophobicContact CG-CG 3.83Å
164	A	97.3	Very high	96.1	Very high	18 Å²	18	47.4 Å²	47.4	15%	0.149	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	158.1	175.5	0	0	0	0	0	109.1	L67 R68 A157 L160 M162	L67-A164 HydrophobicContact CD1-CB 3.87Å; L67-A164 HydrophobicContact CG-CB 4.28Å; R68-A164 CarbonylContact O-C 3.51Å; R68-A164 WeakPolarHBondContact O-CA 3.13Å; R68-A164 WeakPolarHBondContact O-CB 3.4Å; A157-A164 HydrophobicContact CB-CB 4.09Å; L160-A164 HydrophobicContact CD1-CB 3.56Å; M162-A164 PolarHBondContact O-N 2.86Å
165	E	96.7	Very high	96.1	Very high	44 Å²	44	48.3 Å²	48.3	21%	0.206	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	155.4	175.7	71.7	-161.8	139.5	0	0	111.1	R68 K70 V167	R68-E165 HydrophobicContact CB-CG 4.46Å; R68-E165 IonicContact CZ-OE1 3.71Å; R68-E165 VanDerWaalsContact CZ-OE1 3.26Å; R68-E165 PolarHBondContact N-O 2.96Å; R68-E165 IonicContact NE-OE1 3.78Å; R68-E165 PolarHBondContact NE-OE1 3.37Å; R68-E165 IonicContact NH2-OE1 2.87Å; R68-E165 PolarHBondContact NH2-OE1 3.12Å; R68-E165 PolarHBondContact O-N 3.09Å; K70-E165 WeakPolarHBondContact CE-OE1 3.33Å; K70-E165 WeakPolarHBondContact CE-OE2 3.37Å; K70-E165 IonicContact NZ-OE2 2.6Å; K70-E165 PolarHBondContact NZ-OE2 2.94Å; E165-V167 HydrophobicContact CG-CG1 3.9Å
166	M	97.1	Very high	96.2	Very high	30 Å²	30	50.1 Å²	50.1	15%	0.148	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	135.6	163.4	178.5	-176.7	113.8	0	0	108.8	Y65 G66 V146 A149 L150 L153	Y65-M166 HydrophobicContact CD1-CE 4.13Å; Y65-M166 HydrophobicContact CE1-CE 4.47Å; G66-M166 WeakPolarHBondContact O-CA 3.3Å; V146-M166 HydrophobicContact CG1-CE 4.11Å; A149-M166 HydrophobicContact CB-SD 4Å; L150-M166 WeakPolarHBondContact CA-SD 3.16Å; L150-M166 HydrophobicContact CB-SD 4.07Å; L150-M166 HydrophobicContact CD1-CE 4.44Å; L150-M166 HydrophobicContact CD1-SD 4.09Å; L150-M166 PolarHBondContact N-SD 3.42Å; L150-M166 VanDerWaalsContact N-SD 3.45Å; L153-M166 HydrophobicContact CB-CB 4.09Å; L153-M166 HydrophobicContact CB-CG 4.28Å; L153-M166 HydrophobicContact CD1-CB 4.31Å; L153-M166 HydrophobicContact CD1-CG 3.69Å; L153-M166 HydrophobicContact CD1-SD 4.18Å
167	V	97.2	Very high	96.3	Very high	2 Å²	2	56 Å²	56	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.4	168.4	-66.1	0	0	0	0	109.5	Y65 G66 R68 E165 L172	Y65-V167 CarbonylContact C-O 3.56Å; Y65-V167 WeakPolarHBondContact CA-O 3.24Å; G66-V167 PolarHBondContact N-O 2.8Å; G66-V167 PolarHBondContact O-N 3.44Å; R68-V167 HydrophobicContact CB-CG1 3.94Å; R68-V167 HydrophobicContact CB-CG2 3.97Å; E165-V167 HydrophobicContact CG-CG1 3.9Å; V167-L172 HydrophobicContact CB-CD2 4.1Å; V167-L172 HydrophobicContact CB-CG 4.24Å; V167-L172 HydrophobicContact CG1-CD2 4.22Å; V167-L172 HydrophobicContact CG2-CD1 4.41Å; V167-L172 HydrophobicContact CG2-CD2 4.24Å; V167-L172 HydrophobicContact CG2-CG 4.38Å
168	S	96.7	Very high	96.4	Very high	16 Å²	16	63.3 Å²	63.3	11%	0.112	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	166.6	164.3	77.2	0	0	0	0	111.2	Q64 A170 D171 L172	Q64-S168 CarbonylContact O-C 3.55Å; Q64-S168 VanDerWaalsContact O-CA 3.25Å; Q64-S168 WeakPolarHBondContact O-CA 3.5Å; S168-A170 VanDerWaalsContact C-N 3.26Å; S168-A170 PolarHBondContact O-N 2.92Å; S168-A170 PolarHBondContact OG-N 2.86Å; S168-D171 WeakPolarHBondContact CA-OD2 3.26Å; S168-D171 VanDerWaalsContact CB-OD2 3.24Å; S168-D171 WeakPolarHBondContact CB-OD2 3.49Å; S168-D171 PolarHBondContact N-OD2 3.38Å; S168-D171 PolarHBondContact O-N 2.91Å; S168-D171 PolarHBondContact OG-N 3.06Å; S168-D171 PolarHBondContact OG-OD1 3.4Å; S168-D171 PolarHBondContact OG-OD2 3.48Å; S168-L172 WeakPolarHBondContact O-CG 3.41Å; S168-L172 PolarHBondContact O-N 2.87Å; S168-L172 VanDerWaalsContact O-N 3.12Å
169	Q	95.5	Very high	96.4	Very high	53 Å²	53	62.7 Å²	62.7	25%	0.248	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-35.7	175	-178.2	62.1	32.5	0	0	112.8	L60 R63 Q64 I173	L60-Q169 HydrophobicContact CD1-CB 4.33Å; R63-Q169 HydrophobicContact CB-CG 4.11Å; R63-Q169 VanDerWaalsContact O-CB 3.26Å; R63-Q169 WeakPolarHBondContact O-CB 2.96Å; Q64-Q169 PolarHBondContact O-N 3.3Å; Q169-I173 HydrophobicContact CG-CD1 4.3Å; Q169-I173 WeakPolarHBondContact O-CG1 3.06Å; Q169-I173 PolarHBondContact O-N 3.06Å
170	A	95.4	Very high	96.5	Very high	65 Å²	65	65.8 Å²	65.8	54%	0.537	33%	0.332	S	S	.	.	H	α-helix	trans	-66.2	-45.3	176.7	0	0	0	0	0	110.5	S168 L172 I173 E174	S168-A170 VanDerWaalsContact C-N 3.26Å; S168-A170 PolarHBondContact O-N 2.92Å; S168-A170 PolarHBondContact OG-N 2.86Å; A170-L172 VanDerWaalsContact C-N 3.3Å; A170-L172 PolarHBondContact O-N 2.93Å; A170-I173 PolarHBondContact O-N 2.98Å; A170-I173 VanDerWaalsContact O-N 3.13Å; A170-E174 PolarHBondContact O-N 2.97Å
171	D	96.3	Very high	96.6	Very high	58 Å²	58	71.4 Å²	71.4	31%	0.31	36%	0.356	S	S	.	.	H	α-helix	trans	-58.8	-42.3	178.8	-52	-31.9	0	0	0	111.3	S168 I173 E174 E175	S168-D171 WeakPolarHBondContact CA-OD2 3.26Å; S168-D171 VanDerWaalsContact CB-OD2 3.24Å; S168-D171 WeakPolarHBondContact CB-OD2 3.49Å; S168-D171 PolarHBondContact N-OD2 3.38Å; S168-D171 PolarHBondContact O-N 2.91Å; S168-D171 PolarHBondContact OG-N 3.06Å; S168-D171 PolarHBondContact OG-OD1 3.4Å; S168-D171 PolarHBondContact OG-OD2 3.48Å; D171-I173 VanDerWaalsContact C-N 3.34Å; D171-I173 PolarHBondContact O-N 2.89Å; D171-E174 PolarHBondContact O-N 3.27Å; D171-E175 WeakPolarHBondContact O-CB 3.26Å; D171-E175 VanDerWaalsContact O-CG 3.24Å; D171-E175 WeakPolarHBondContact O-CG 3.5Å; D171-E175 PolarHBondContact O-N 3.12Å
172	L	96.4	Very high	96.7	Very high	28 Å²	28	72.4 Å²	72.4	15%	0.147	36%	0.356	C	S	.	.	H	α-helix	trans	-64.4	-37	178.6	-69.7	179.3	0	0	0	113	L60 V167 S168 A170 E176	L60-L172 HydrophobicContact CD1-CD1 3.83Å; L60-L172 HydrophobicContact CG-CD1 3.84Å; V167-L172 HydrophobicContact CB-CD2 4.1Å; V167-L172 HydrophobicContact CB-CG 4.24Å; V167-L172 HydrophobicContact CG1-CD2 4.22Å; V167-L172 HydrophobicContact CG2-CD1 4.41Å; V167-L172 HydrophobicContact CG2-CD2 4.24Å; V167-L172 HydrophobicContact CG2-CG 4.38Å; S168-L172 WeakPolarHBondContact O-CG 3.41Å; S168-L172 PolarHBondContact O-N 2.87Å; S168-L172 VanDerWaalsContact O-N 3.12Å; A170-L172 VanDerWaalsContact C-N 3.3Å; A170-L172 PolarHBondContact O-N 2.93Å; L172-E176 WeakPolarHBondContact O-CB 3.38Å; L172-E176 PolarHBondContact O-N 2.73Å; L172-E176 VanDerWaalsContact O-N 3.16Å
173	I	97.1	Very high	96.6	Very high	76 Å²	76	75.6 Å²	75.6	39%	0.39	38%	0.384	S	S	.	.	H	α-helix	trans	-69.9	-47	177.3	-67.2	166.4	0	0	0	109.6	Q169 A170 D171 E175 E176 E177	Q169-I173 HydrophobicContact CG-CD1 4.3Å; Q169-I173 WeakPolarHBondContact O-CG1 3.06Å; Q169-I173 PolarHBondContact O-N 3.06Å; A170-I173 PolarHBondContact O-N 2.98Å; A170-I173 VanDerWaalsContact O-N 3.13Å; D171-I173 VanDerWaalsContact C-N 3.34Å; D171-I173 PolarHBondContact O-N 2.89Å; I173-E175 VanDerWaalsContact C-N 3.34Å; I173-E175 PolarHBondContact O-N 3.05Å; I173-E176 PolarHBondContact O-N 3.04Å; I173-E177 HydrophobicContact CG2-CG 4.43Å; I173-E177 WeakPolarHBondContact O-CG 3.39Å; I173-E177 PolarHBondContact O-N 3.3Å
174	E	97.6	Very high	96.6	Very high	122 Å²	122	81 Å²	81	57%	0.57	40%	0.401	S	S	*	.	H	α-helix	trans	-60.6	-43.8	178.7	-172.8	-174.8	166.1	0	0	111.3	A170 D171 E176 E177 R178	A170-E174 PolarHBondContact O-N 2.97Å; D171-E174 PolarHBondContact O-N 3.27Å; E174-E176 PolarHBondContact O-N 3.19Å; E174-E177 PolarHBondContact O-N 3.43Å; E174-R178 WeakPolarHBondContact O-CB 3.48Å; E174-R178 PolarHBondContact O-N 3.43Å
175	E	96.5	Very high	96.6	Very high	67 Å²	67	83.9 Å²	83.9	31%	0.313	41%	0.414	S	S	.	.	H	α-helix	trans	-59.8	-44.1	175.2	-77.4	178.9	164.1	0	0	112	R68 D171 I173 R178 E179	R68-E175 IonicContact CZ-OE1 3.02Å; R68-E175 IonicContact CZ-OE2 3.73Å; R68-E175 VanDerWaalsContact CZ-OE2 3.28Å; R68-E175 IonicContact NH1-OE1 4Å; R68-E175 IonicContact NH1-OE2 2.73Å; R68-E175 PolarHBondContact NH1-OE2 3.08Å; R68-E175 VanDerWaalsContact NH2-CD 3.32Å; R68-E175 IonicContact NH2-OE1 3.88Å; R68-E175 PolarHBondContact NH2-OE1 3.22Å; R68-E175 IonicContact NH2-OE2 3.8Å; R68-E175 PolarHBondContact NH2-OE2 3.47Å; D171-E175 WeakPolarHBondContact O-CB 3.26Å; D171-E175 VanDerWaalsContact O-CG 3.24Å; D171-E175 WeakPolarHBondContact O-CG 3.5Å; D171-E175 PolarHBondContact O-N 3.12Å; I173-E175 VanDerWaalsContact C-N 3.34Å; I173-E175 PolarHBondContact O-N 3.05Å; E175-R178 PolarHBondContact O-N 3.35Å; E175-E179 WeakPolarHBondContact O-CB 3.5Å; E175-E179 WeakPolarHBondContact O-CG 3.34Å; E175-E179 PolarHBondContact O-N 3.05Å
176	E	96.2	Very high	96.6	Very high	100 Å²	100	85.5 Å²	85.5	47%	0.467	42%	0.424	S	S	.	.	H	α-helix	trans	-64.9	-43.8	178.4	-170.7	-176.6	162.8	0	0	111.6	L172 I173 E174 E179 K180	L172-E176 WeakPolarHBondContact O-CB 3.38Å; L172-E176 PolarHBondContact O-N 2.73Å; L172-E176 VanDerWaalsContact O-N 3.16Å; I173-E176 PolarHBondContact O-N 3.04Å; E174-E176 PolarHBondContact O-N 3.19Å; E176-E179 PolarHBondContact O-N 3.12Å; E176-K180 WeakPolarHBondContact O-CG 3.39Å; E176-K180 PolarHBondContact O-N 3.03Å; E176-K180 VanDerWaalsContact OE1-CE 3.28Å; E176-K180 WeakPolarHBondContact OE1-CE 3.47Å; E176-K180 IonicContact OE1-NZ 2.68Å; E176-K180 PolarHBondContact OE1-NZ 3.36Å
177	E	97.9	Very high	96.5	Very high	124 Å²	124	92.1 Å²	92.1	58%	0.579	46%	0.459	S	S	*	.	H	α-helix	trans	-63.3	-42.8	176	-72.2	178.3	175.8	0	0	111.5	I173 E174 K180 F181	I173-E177 HydrophobicContact CG2-CG 4.43Å; I173-E177 WeakPolarHBondContact O-CG 3.39Å; I173-E177 PolarHBondContact O-N 3.3Å; E174-E177 PolarHBondContact O-N 3.43Å; E177-K180 PolarHBondContact O-N 3.34Å; E177-F181 WeakPolarHBondContact O-CB 3.48Å; E177-F181 PolarHBondContact O-N 3.39Å
178	R	98.2	Very high	96.4	Very high	167 Å²	167	96.3 Å²	96.3	63%	0.63	48%	0.481	S	S	*	.	H	α-helix	trans	-63.4	-43.8	176.5	-176.1	178.8	-180	-176.2	1.3	111.6	E174 E175 K180 F181 I182	E174-R178 WeakPolarHBondContact O-CB 3.48Å; E174-R178 PolarHBondContact O-N 3.43Å; E175-R178 PolarHBondContact O-N 3.35Å; R178-K180 VanDerWaalsContact C-N 3.34Å; R178-K180 PolarHBondContact O-N 2.78Å; R178-F181 PolarHBondContact O-N 3.09Å; R178-I182 HydrophobicContact CG-CD1 3.92Å; R178-I182 HydrophobicContact CG-CG1 4.5Å; R178-I182 VanDerWaalsContact O-CG1 3.27Å; R178-I182 WeakPolarHBondContact O-CG1 3.36Å; R178-I182 PolarHBondContact O-N 3.43Å
179	E	95.8	Very high	96.2	Very high	122 Å²	122	106 Å²	106	57%	0.57	52%	0.515	S	S	*	.	H	α-helix	trans	-60.8	-43.7	175.4	-78.5	-165	172.4	0	0	111.5	E175 E176 I182 A183	E175-E179 WeakPolarHBondContact O-CB 3.5Å; E175-E179 WeakPolarHBondContact O-CG 3.34Å; E175-E179 PolarHBondContact O-N 3.05Å; E176-E179 PolarHBondContact O-N 3.12Å; E179-I182 PolarHBondContact O-N 3.27Å; E179-A183 WeakPolarHBondContact O-CB 3.4Å; E179-A183 PolarHBondContact O-N 2.91Å
180	K	97.1	Very high	96.1	Very high	122 Å²	122	109.2 Å²	109.2	53%	0.53	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-42.3	175.6	-72.5	170.5	-174.1	165.3	0	111.8	E176 E177 R178 A183 K184	E176-K180 WeakPolarHBondContact O-CG 3.39Å; E176-K180 PolarHBondContact O-N 3.03Å; E176-K180 VanDerWaalsContact OE1-CE 3.28Å; E176-K180 WeakPolarHBondContact OE1-CE 3.47Å; E176-K180 IonicContact OE1-NZ 2.68Å; E176-K180 PolarHBondContact OE1-NZ 3.36Å; E177-K180 PolarHBondContact O-N 3.34Å; R178-K180 VanDerWaalsContact C-N 3.34Å; R178-K180 PolarHBondContact O-N 2.78Å; K180-A183 PolarHBondContact O-N 3.02Å; K180-K184 WeakPolarHBondContact O-CB 3.07Å; K180-K184 PolarHBondContact O-N 2.72Å
181	F	98.1	Very high	96	Very high	133 Å²	133	108.4 Å²	108.4	58%	0.583	52%	0.517	S	S	*	.	H	α-helix	trans	-62.6	-47.6	177.8	178.8	-89.8	0	0	0	111.4	E177 R178 A183 K184 N185	E177-F181 WeakPolarHBondContact O-CB 3.48Å; E177-F181 PolarHBondContact O-N 3.39Å; R178-F181 PolarHBondContact O-N 3.09Å; F181-A183 VanDerWaalsContact C-N 3.35Å; F181-A183 PolarHBondContact O-N 2.6Å; F181-K184 PolarHBondContact O-N 2.91Å; F181-N185 WeakPolarHBondContact CD2-ND2 3.18Å; F181-N185 WeakPolarHBondContact CE1-ND2 3.26Å; F181-N185 WeakPolarHBondContact CE2-ND2 3.31Å; F181-N185 WeakPolarHBondContact CG-ND2 3.43Å; F181-N185 WeakPolarHBondContact CZ-ND2 3.49Å; F181-N185 WeakPolarHBondContact O-CB 3.44Å; F181-N185 PolarHBondContact O-N 3.28Å; F181-N185 PolarHBondContact O-ND2 3.04Å; F181-N185 VanDerWaalsContact O-ND2 3.15Å
182	I	97	Very high	95.8	Very high	97 Å²	97	112.8 Å²	112.8	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-61.7	-45	177.5	-68.4	166.9	0	0	0	110.2	R178 E179 K184 N185 N186	R178-I182 HydrophobicContact CG-CD1 3.92Å; R178-I182 HydrophobicContact CG-CG1 4.5Å; R178-I182 VanDerWaalsContact O-CG1 3.27Å; R178-I182 WeakPolarHBondContact O-CG1 3.36Å; R178-I182 PolarHBondContact O-N 3.43Å; E179-I182 PolarHBondContact O-N 3.27Å; I182-K184 VanDerWaalsContact C-N 3.34Å; I182-K184 PolarHBondContact O-N 3.32Å; I182-N185 PolarHBondContact O-N 3.07Å; I182-N186 WeakPolarHBondContact O-CB 3.43Å; I182-N186 PolarHBondContact O-N 3.48Å
183	A	93.2	Very high	95.6	Very high	77 Å²	77	116.1 Å²	116.1	64%	0.636	54%	0.544	S	S	*	.	H	α-helix	trans	-61.3	-40.5	178.5	0	0	0	0	0	112.5	E179 K180 F181	E179-A183 WeakPolarHBondContact O-CB 3.4Å; E179-A183 PolarHBondContact O-N 2.91Å; K180-A183 PolarHBondContact O-N 3.02Å; F181-A183 VanDerWaalsContact C-N 3.35Å; F181-A183 PolarHBondContact O-N 2.6Å
184	K	95.7	Very high	95.5	Very high	179 Å²	179	117.6 Å²	117.6	78%	0.778	55%	0.546	S	S	*	.	H	α-helix	trans	-71.4	-40.4	179.1	-174.7	179.5	178	-177.2	0	112.7	K180 F181 I182	K180-K184 WeakPolarHBondContact O-CB 3.07Å; K180-K184 PolarHBondContact O-N 2.72Å; F181-K184 PolarHBondContact O-N 2.91Å; I182-K184 VanDerWaalsContact C-N 3.34Å; I182-K184 PolarHBondContact O-N 3.32Å
185	N	97.2	Very high	95.4	Very high	79 Å²	79	113.2 Å²	113.2	42%	0.422	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	12.5	-174.5	-62	-43.9	0	0	0	113.4	F181 I182 L187	F181-N185 WeakPolarHBondContact CD2-ND2 3.18Å; F181-N185 WeakPolarHBondContact CE1-ND2 3.26Å; F181-N185 WeakPolarHBondContact CE2-ND2 3.31Å; F181-N185 WeakPolarHBondContact CG-ND2 3.43Å; F181-N185 WeakPolarHBondContact CZ-ND2 3.49Å; F181-N185 WeakPolarHBondContact O-CB 3.44Å; F181-N185 PolarHBondContact O-N 3.28Å; F181-N185 PolarHBondContact O-ND2 3.04Å; F181-N185 VanDerWaalsContact O-ND2 3.15Å; I182-N185 PolarHBondContact O-N 3.07Å; N185-L187 PolarHBondContact O-N 2.98Å; N185-L187 VanDerWaalsContact O-N 3.09Å
186	N	95.9	Very high	95.3	Very high	78 Å²	78	110.4 Å²	110.4	42%	0.417	51%	0.514	S	S	.	.			trans	-68.1	109.4	177.4	-176.8	15.5	0	0	0	110.4	I182 N188 T191	I182-N186 WeakPolarHBondContact O-CB 3.43Å; I182-N186 PolarHBondContact O-N 3.48Å; N186-N188 VanDerWaalsContact C-N 3.32Å; N186-N188 WeakPolarHBondContact OD1-CB 3.35Å; N186-N188 PolarHBondContact OD1-N 3.06Å; N186-T191 WeakPolarHBondContact ND2-CG2 3.28Å
187	L	95.7	Very high	95.2	Very high	170 Å²	170	113.2 Å²	113.2	89%	0.89	53%	0.525	S	S	*	.			trans	-74.6	-22.4	177.1	-63.3	174.2	0	0	0	112.8	N185 R189	N185-L187 PolarHBondContact O-N 2.98Å; N185-L187 VanDerWaalsContact O-N 3.09Å; L187-R189 PolarHBondContact O-N 2.7Å
188	N	95.1	Very high	95.1	Very high	90 Å²	90	114.8 Å²	114.8	48%	0.481	53%	0.526	S	S	.	.			trans	-72.3	118.3	-178.4	-177.6	9.3	0	0	0	110.5	N186 F190	N186-N188 VanDerWaalsContact C-N 3.32Å; N186-N188 WeakPolarHBondContact OD1-CB 3.35Å; N186-N188 PolarHBondContact OD1-N 3.06Å; N188-F190 VanDerWaalsContact C-N 3.3Å; N188-F190 PolarHBondContact ND2-O 3.1Å; N188-F190 PolarHBondContact O-N 2.83Å; N188-F190 PolarHBondContact OD1-N 3.41Å
189	R	92	Very high	95	Very high	218 Å²	218	109.8 Å²	109.8	82%	0.823	51%	0.511	S	S	*	.	S	Bend	trans	-66.8	-30.6	177.7	-61	-176.9	-179.4	-156.6	0	112.7	L187 T191	L187-R189 PolarHBondContact O-N 2.7Å; R189-T191 PolarHBondContact O-N 3.19Å
190	F	93.8	Very high	94.9	Very high	121 Å²	121	107 Å²	107	53%	0.531	50%	0.499	S	S	.	.			trans	-94.2	77	-176.6	-57.3	-67.3	0	0	0	110.9	N188 Y194 V195 M200	N188-F190 VanDerWaalsContact C-N 3.3Å; N188-F190 PolarHBondContact ND2-O 3.1Å; N188-F190 PolarHBondContact O-N 2.83Å; N188-F190 PolarHBondContact OD1-N 3.41Å; F190-Y194 HydrophobicContact CD1-CD1 4.29Å; F190-Y194 HydrophobicContact CD1-CE1 4.34Å; F190-V195 HydrophobicContact CB-CG2 4.13Å; F190-M200 HydrophobicContact CD1-CE 4.1Å; F190-M200 HydrophobicContact CD1-SD 4.18Å; F190-M200 HydrophobicContact CE1-CE 3.83Å; F190-M200 HydrophobicContact CE1-SD 4.37Å
191	T	93.9	Very high	94.8	Very high	48 Å²	48	109.3 Å²	109.3	29%	0.294	51%	0.512	S	S	.	.			trans	-75.6	155.3	169.9	65.6	0	0	0	0	110.7	N186 R189 E193 Y194 V195	N186-T191 WeakPolarHBondContact ND2-CG2 3.28Å; R189-T191 PolarHBondContact O-N 3.19Å; T191-E193 PolarHBondContact O-N 2.83Å; T191-Y194 WeakPolarHBondContact O-CB 3.15Å; T191-Y194 PolarHBondContact O-N 2.86Å; T191-Y194 VanDerWaalsContact OG1-CB 3.3Å; T191-Y194 WeakPolarHBondContact OG1-CB 3.48Å; T191-Y194 PolarHBondContact OG1-N 3.14Å; T191-Y194 VanDerWaalsContact OG1-N 3.13Å; T191-V195 WeakPolarHBondContact O-CG2 3.43Å; T191-V195 PolarHBondContact O-N 3.13Å
192	W	92.4	Very high	94.7	Very high	151 Å²	151	106.9 Å²	106.9	57%	0.572	51%	0.505	S	S	*	.	H	α-helix	trans	-52	-43.6	172.8	-85.7	114	0	0	0	111.8	Y194 V195 M196 L207 K215	W192-Y194 VanDerWaalsContact C-N 3.33Å; W192-Y194 PolarHBondContact O-N 2.92Å; W192-V195 PolarHBondContact O-N 3.46Å; W192-M196 HydrophobicContact CB-CE 4.31Å; W192-M196 HydrophobicContact CD2-CE 4.1Å; W192-M196 HydrophobicContact CE3-CE 3.41Å; W192-M196 VanDerWaalsContact CE3-CE 3.41Å; W192-M196 HydrophobicContact CZ3-CE 4Å; W192-M196 VanDerWaalsContact O-CB 3.25Å; W192-M196 WeakPolarHBondContact O-CB 3.45Å; W192-M196 WeakPolarHBondContact O-CG 3.43Å; W192-M196 PolarHBondContact O-N 3.41Å; W192-L207 HydrophobicContact CZ3-CD2 4.43Å; W192-K215 WeakPolarHBondContact CB-O 3.24Å
193	E	92.3	Very high	94.5	Very high	97 Å²	97	102.8 Å²	102.8	45%	0.453	49%	0.485	S	S	.	.	H	α-helix	trans	-58.2	-45	176.1	-59.6	-173.2	-159.2	0	0	112	T191 K197 K215	T191-E193 PolarHBondContact O-N 2.83Å; E193-K197 WeakPolarHBondContact O-CB 3.45Å; E193-K197 PolarHBondContact O-N 3.27Å; E193-K215 HydrophobicContact CG-CB 3.94Å; E193-K215 HydrophobicContact CG-CD 3.8Å; E193-K215 HydrophobicContact CG-CG 3.8Å; E193-K215 WeakPolarHBondContact OE1-CD 3.27Å; E193-K215 WeakPolarHBondContact OE1-CE 3.45Å; E193-K215 IonicContact OE1-NZ 3.82Å; E193-K215 PolarHBondContact OE1-NZ 3.24Å; E193-K215 WeakPolarHBondContact OE2-CE 3.32Å; E193-K215 IonicContact OE2-NZ 3.69Å; E193-K215 PolarHBondContact OE2-NZ 2.95Å
194	Y	94.2	Very high	94.5	Very high	107 Å²	107	106.2 Å²	106.2	42%	0.42	48%	0.482	S	S	.	.	H	α-helix	trans	-66	-48.8	-179.6	-174.1	-89.5	0	0	0	111.9	F190 T191 W192 M196 K197 W198 M200	F190-Y194 HydrophobicContact CD1-CD1 4.29Å; F190-Y194 HydrophobicContact CD1-CE1 4.34Å; T191-Y194 WeakPolarHBondContact O-CB 3.15Å; T191-Y194 PolarHBondContact O-N 2.86Å; T191-Y194 VanDerWaalsContact OG1-CB 3.3Å; T191-Y194 WeakPolarHBondContact OG1-CB 3.48Å; T191-Y194 PolarHBondContact OG1-N 3.14Å; T191-Y194 VanDerWaalsContact OG1-N 3.13Å; W192-Y194 VanDerWaalsContact C-N 3.33Å; W192-Y194 PolarHBondContact O-N 2.92Å; Y194-M196 VanDerWaalsContact C-N 3.34Å; Y194-M196 PolarHBondContact O-N 3.12Å; Y194-K197 PolarHBondContact O-N 2.92Å; Y194-W198 AromaticContact CD2-CD1 3.95Å; Y194-W198 AromaticContact CD2-NE1 3.91Å; Y194-W198 AromaticContact CE1-CD1 3.8Å; Y194-W198 AromaticContact CE2-CD1 3.69Å; Y194-W198 AromaticContact CE2-NE1 3.44Å; Y194-W198 AromaticContact CZ-CD1 3.6Å; Y194-W198 AromaticContact CZ-NE1 3.68Å; Y194-W198 VanDerWaalsContact O-CD1 3.32Å; Y194-W198 PolarHBondContact O-N 3.47Å; Y194-M200 HydrophobicContact CD1-SD 3.95Å; Y194-M200 HydrophobicContact CE1-SD 3.83Å
195	V	95.1	Very high	94.5	Very high	30 Å²	30	106.9 Å²	106.9	18%	0.182	48%	0.48	C	S	.	.	H	α-helix	trans	-60.2	-45.3	179.6	170.3	0	0	0	0	110.8	F190 T191 W192 N199 M200	F190-V195 HydrophobicContact CB-CG2 4.13Å; T191-V195 WeakPolarHBondContact O-CG2 3.43Å; T191-V195 PolarHBondContact O-N 3.13Å; W192-V195 PolarHBondContact O-N 3.46Å; V195-N199 PolarHBondContact O-N 2.96Å; V195-M200 HydrophobicContact CG1-CB 4.13Å; V195-M200 HydrophobicContact CG2-SD 4.2Å; V195-M200 PolarHBondContact O-N 3.42Å
196	M	94.8	Very high	94.2	Very high	8 Å²	8	111.5 Å²	111.5	4%	0.039	49%	0.491	C	S	.	.	H	α-helix	trans	-66.5	-46	178.3	-72.3	179.7	-169.8	0	0	111.8	W192 Y194 W198 N199 L207 D211 Y212	W192-M196 HydrophobicContact CB-CE 4.31Å; W192-M196 HydrophobicContact CD2-CE 4.1Å; W192-M196 HydrophobicContact CE3-CE 3.41Å; W192-M196 VanDerWaalsContact CE3-CE 3.41Å; W192-M196 HydrophobicContact CZ3-CE 4Å; W192-M196 VanDerWaalsContact O-CB 3.25Å; W192-M196 WeakPolarHBondContact O-CB 3.45Å; W192-M196 WeakPolarHBondContact O-CG 3.43Å; W192-M196 PolarHBondContact O-N 3.41Å; Y194-M196 VanDerWaalsContact C-N 3.34Å; Y194-M196 PolarHBondContact O-N 3.12Å; M196-W198 VanDerWaalsContact C-N 3.28Å; M196-W198 PolarHBondContact O-N 3.48Å; M196-N199 PolarHBondContact O-N 3.39Å; M196-N199 VanDerWaalsContact O-N 3.08Å; M196-L207 HydrophobicContact CE-CD1 3.96Å; M196-L207 HydrophobicContact CG-CD1 3.8Å; M196-L207 HydrophobicContact SD-CD1 4.4Å; M196-D211 HydrophobicContact CE-CB 4.13Å; M196-Y212 HydrophobicContact CB-CD1 3.86Å; M196-Y212 HydrophobicContact CB-CE1 3.64Å; M196-Y212 HydrophobicContact CG-CD1 4.39Å; M196-Y212 HydrophobicContact CG-CE1 4.2Å; M196-Y212 WeakPolarHBondContact O-CE1 3.31Å; M196-Y212 HydrophobicContact SD-CD1 4.39Å; M196-Y212 HydrophobicContact SD-CG 4.46Å
197	K	94	Very high	94.1	Very high	159 Å²	159	109.6 Å²	109.6	69%	0.691	48%	0.481	S	S	*	.	H	α-helix	trans	-57	-41.1	-178.6	179.5	178.5	178.6	-179.9	0	112.4	E193 Y194 N199	E193-K197 WeakPolarHBondContact O-CB 3.45Å; E193-K197 PolarHBondContact O-N 3.27Å; Y194-K197 PolarHBondContact O-N 2.92Å; K197-N199 VanDerWaalsContact C-N 3.34Å
198	W	95.6	Very high	94	Very high	157 Å²	157	103.1 Å²	103.1	60%	0.595	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	8.9	-179	-64.5	115	0	0	0	113.8	Y194 M196 M200	Y194-W198 AromaticContact CD2-CD1 3.95Å; Y194-W198 AromaticContact CD2-NE1 3.91Å; Y194-W198 AromaticContact CE1-CD1 3.8Å; Y194-W198 AromaticContact CE2-CD1 3.69Å; Y194-W198 AromaticContact CE2-NE1 3.44Å; Y194-W198 AromaticContact CZ-CD1 3.6Å; Y194-W198 AromaticContact CZ-NE1 3.68Å; Y194-W198 VanDerWaalsContact O-CD1 3.32Å; Y194-W198 PolarHBondContact O-N 3.47Å; M196-W198 VanDerWaalsContact C-N 3.28Å; M196-W198 PolarHBondContact O-N 3.48Å; W198-M200 HydrophobicContact CB-CG 3.94Å; W198-M200 PolarHBondContact O-N 3.38Å; W198-M200 VanDerWaalsContact O-N 3.1Å
199	N	95.3	Very high	94	Very high	62 Å²	62	103.1 Å²	103.1	33%	0.332	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	44	42.8	-174.2	-170.7	28.1	0	0	0	112.4	V195 M196 K197 Q201 N202 C203 Y204	V195-N199 PolarHBondContact O-N 2.96Å; M196-N199 PolarHBondContact O-N 3.39Å; M196-N199 VanDerWaalsContact O-N 3.08Å; K197-N199 VanDerWaalsContact C-N 3.34Å; N199-Q201 PolarHBondContact O-N 3.4Å; N199-N202 PolarHBondContact ND2-OD1 2.91Å; N199-N202 PolarHBondContact O-N 3.01Å; N199-N202 VanDerWaalsContact OD1-C 3.24Å; N199-N202 WeakPolarHBondContact OD1-CA 3.46Å; N199-C203 PolarHBondContact OD1-N 3.2Å; N199-C203 VanDerWaalsContact OD1-N 3.11Å; N199-Y204 WeakPolarHBondContact OD1-CB 3.42Å; N199-Y204 PolarHBondContact OD1-N 3.08Å
200	M	95.3	Very high	94.1	Very high	63 Å²	63	97.2 Å²	97.2	31%	0.31	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-60.9	137.5	-174.8	-67.1	-174.7	68	0	0	109.9	F190 Y194 V195 W198 N202 C203	F190-M200 HydrophobicContact CD1-CE 4.1Å; F190-M200 HydrophobicContact CD1-SD 4.18Å; F190-M200 HydrophobicContact CE1-CE 3.83Å; F190-M200 HydrophobicContact CE1-SD 4.37Å; Y194-M200 HydrophobicContact CD1-SD 3.95Å; Y194-M200 HydrophobicContact CE1-SD 3.83Å; V195-M200 HydrophobicContact CG1-CB 4.13Å; V195-M200 HydrophobicContact CG2-SD 4.2Å; V195-M200 PolarHBondContact O-N 3.42Å; W198-M200 HydrophobicContact CB-CG 3.94Å; W198-M200 PolarHBondContact O-N 3.38Å; W198-M200 VanDerWaalsContact O-N 3.1Å; M200-N202 PolarHBondContact O-N 3.38Å; M200-N202 VanDerWaalsContact O-N 3.11Å; M200-C203 WeakPolarHBondContact O-CB 3.23Å; M200-C203 PolarHBondContact O-N 3.35Å; M200-C203 VanDerWaalsContact O-N 3.13Å
201	Q	94.8	Very high	94.1	Very high	172 Å²	172	92.7 Å²	92.7	80%	0.804	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	54.7	24.8	-175.1	-55	-177.6	-69	0	0	113.8	N199 C203 W206	N199-Q201 PolarHBondContact O-N 3.4Å; Q201-C203 VanDerWaalsContact C-N 3.26Å; Q201-C203 PolarHBondContact O-N 3.12Å; Q201-W206 WeakPolarHBondContact O-CH2 3.12Å; Q201-W206 VanDerWaalsContact O-CZ3 3.26Å; Q201-W206 WeakPolarHBondContact O-CZ3 3.38Å
202	N	95	Very high	94.1	Very high	82 Å²	82	93.6 Å²	93.6	44%	0.439	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	56.7	38.3	-176	-162.7	19.9	0	0	0	113.2	N199 M200 Y204 R205	N199-N202 PolarHBondContact ND2-OD1 2.91Å; N199-N202 PolarHBondContact O-N 3.01Å; N199-N202 VanDerWaalsContact OD1-C 3.24Å; N199-N202 WeakPolarHBondContact OD1-CA 3.46Å; M200-N202 PolarHBondContact O-N 3.38Å; M200-N202 VanDerWaalsContact O-N 3.11Å; N202-Y204 PolarHBondContact O-N 3.31Å; N202-Y204 VanDerWaalsContact O-N 3.09Å; N202-R205 WeakPolarHBondContact O-CB 3.41Å; N202-R205 PolarHBondContact O-N 2.74Å
203	C	94	Very high	94.2	Very high	10 Å²	10	91.4 Å²	91.4	7%	0.068	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-56.9	-25.4	-178.2	63	0	0	0	0	113.8	N199 M200 Q201 R205 W206 L207	N199-C203 PolarHBondContact OD1-N 3.2Å; N199-C203 VanDerWaalsContact OD1-N 3.11Å; M200-C203 WeakPolarHBondContact O-CB 3.23Å; M200-C203 PolarHBondContact O-N 3.35Å; M200-C203 VanDerWaalsContact O-N 3.13Å; Q201-C203 VanDerWaalsContact C-N 3.26Å; Q201-C203 PolarHBondContact O-N 3.12Å; C203-R205 PolarHBondContact O-N 3.03Å; C203-R205 VanDerWaalsContact O-N 3.12Å; C203-W206 PolarHBondContact O-N 3.1Å; C203-L207 HydrophobicContact CB-CD1 3.91Å; C203-L207 WeakPolarHBondContact O-CG 3.32Å; C203-L207 PolarHBondContact O-N 3.17Å
204	Y	92.3	Very high	94.3	Very high	150 Å²	150	88.3 Å²	88.3	59%	0.588	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-53.8	-30.5	174	-178.3	-101	0	0	0	113.5	N199 N202 W206 Y212	N199-Y204 WeakPolarHBondContact OD1-CB 3.42Å; N199-Y204 PolarHBondContact OD1-N 3.08Å; N202-Y204 PolarHBondContact O-N 3.31Å; N202-Y204 VanDerWaalsContact O-N 3.09Å; Y204-W206 VanDerWaalsContact C-N 3.26Å; Y204-W206 PolarHBondContact O-N 2.9Å; Y204-Y212 WeakPolarHBondContact CA-OH 3.31Å; Y204-Y212 WeakPolarHBondContact CB-OH 3.41Å; Y204-Y212 AromaticContact CD2-CE2 3.93Å; Y204-Y212 HydrophobicContact CD2-CE2 3.93Å; Y204-Y212 AromaticContact CD2-CZ 3.87Å; Y204-Y212 PolarHBondContact N-OH 3.42Å
205	R	95.2	Very high	94.2	Very high	192 Å²	192	87.5 Å²	87.5	73%	0.725	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-64.8	-29.9	179	-175.7	176.3	176.4	-178.5	0.1	113	N202 C203	N202-R205 WeakPolarHBondContact O-CB 3.41Å; N202-R205 PolarHBondContact O-N 2.74Å; C203-R205 PolarHBondContact O-N 3.03Å; C203-R205 VanDerWaalsContact O-N 3.12Å
206	W	92	Very high	94	Very high	176 Å²	176	87.7 Å²	87.7	67%	0.667	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-20	-172.8	-44.2	-59.6	0	0	0	113.2	Q201 C203 Y204	Q201-W206 WeakPolarHBondContact O-CH2 3.12Å; Q201-W206 VanDerWaalsContact O-CZ3 3.26Å; Q201-W206 WeakPolarHBondContact O-CZ3 3.38Å; C203-W206 PolarHBondContact O-N 3.1Å; Y204-W206 VanDerWaalsContact C-N 3.26Å; Y204-W206 PolarHBondContact O-N 2.9Å
207	L	93.8	Very high	93.9	Very high	38 Å²	38	94 Å²	94	20%	0.199	43%	0.434	C	S	.	.	S	Bend	trans	-85.6	144.4	179.5	-68.2	174.7	0	0	0	111.8	W192 M196 C203 D211 Y212	W192-L207 HydrophobicContact CZ3-CD2 4.43Å; M196-L207 HydrophobicContact CE-CD1 3.96Å; M196-L207 HydrophobicContact CG-CD1 3.8Å; M196-L207 HydrophobicContact SD-CD1 4.4Å; C203-L207 HydrophobicContact CB-CD1 3.91Å; C203-L207 WeakPolarHBondContact O-CG 3.32Å; C203-L207 PolarHBondContact O-N 3.17Å; L207-D211 HydrophobicContact CB-CB 4.37Å; L207-D211 HydrophobicContact CD2-CB 4.18Å; L207-Y212 HydrophobicContact CB-CE2 3.91Å; L207-Y212 HydrophobicContact CD1-CE2 4.38Å
208	S	93.3	Very high	93.9	Very high	35 Å²	35	90.1 Å²	90.1	25%	0.245	42%	0.416	C	S	.	.			trans	-74.5	149.1	170.8	-170.8	0	0	0	0	110	Y210 D211 Y212	S208-Y210 PolarHBondContact O-N 3.37Å; S208-D211 WeakPolarHBondContact CB-OD2 3.28Å; S208-D211 PolarHBondContact N-OD2 2.61Å; S208-D211 WeakPolarHBondContact O-CB 3.43Å; S208-D211 PolarHBondContact O-N 3.2Å; S208-Y212 WeakPolarHBondContact O-CD2 3.29Å
209	P	94.2	Very high	93.4	Very high	89 Å²	89	95.5 Å²	95.5	58%	0.578	44%	0.436	S	S	*	.	H	α-helix	trans	-52.8	-29.5	169.8	-28.3	35.8	0	0	0	113.5	D211 Y212 V213	P209-D211 VanDerWaalsContact C-N 3.33Å; P209-Y212 WeakPolarHBondContact O-CB 3.47Å; P209-Y212 PolarHBondContact O-N 3.09Å; P209-V213 PolarHBondContact O-N 2.8Å
210	Y	95.2	Very high	93.3	Very high	95 Å²	95	97.2 Å²	97.2	37%	0.373	44%	0.441	S	S	.	.	H	α-helix	trans	-70.7	-27.3	176.6	-66.1	-77.6	0	0	0	113.6	I48 S208 Y212 V213 W214	I48-Y210 HydrophobicContact CD1-CD1 4.18Å; I48-Y210 HydrophobicContact CD1-CE1 3.42Å; I48-Y210 VanDerWaalsContact CD1-CE1 3.42Å; I48-Y210 HydrophobicContact CD1-CE2 4.37Å; I48-Y210 WeakPolarHBondContact CD1-OH 3.44Å; I48-Y210 HydrophobicContact CG1-CE1 4.46Å; S208-Y210 PolarHBondContact O-N 3.37Å; Y210-Y212 PolarHBondContact O-N 3.38Å; Y210-V213 PolarHBondContact O-N 3.07Å; Y210-W214 AromaticContact CD1-CH2 3.67Å; Y210-W214 HydrophobicContact CD1-CH2 3.67Å; Y210-W214 AromaticContact CD1-CZ2 3.75Å; Y210-W214 HydrophobicContact CD1-CZ2 3.75Å; Y210-W214 HydrophobicContact CD1-CZ3 4.3Å; Y210-W214 AromaticContact CG-CH2 3.99Å; Y210-W214 HydrophobicContact CG-CH2 3.99Å; Y210-W214 HydrophobicContact CG-CZ2 4.44Å; Y210-W214 HydrophobicContact CG-CZ3 4.2Å; Y210-W214 WeakPolarHBondContact O-CB 3.48Å; Y210-W214 PolarHBondContact O-N 3.35Å
211	D	94.4	Very high	93.2	Very high	26 Å²	26	98.9 Å²	98.9	14%	0.139	45%	0.448	C	S	.	.	H	α-helix	trans	-67.4	-32.1	178	-56.7	-29.3	0	0	0	110.2	R51 M196 L207 S208 P209 K215 G216	R51-D211 IonicContact NH2-OD1 2.79Å; M196-D211 HydrophobicContact CE-CB 4.13Å; L207-D211 HydrophobicContact CB-CB 4.37Å; L207-D211 HydrophobicContact CD2-CB 4.18Å; S208-D211 WeakPolarHBondContact CB-OD2 3.28Å; S208-D211 PolarHBondContact N-OD2 2.61Å; S208-D211 WeakPolarHBondContact O-CB 3.43Å; S208-D211 PolarHBondContact O-N 3.2Å; P209-D211 VanDerWaalsContact C-N 3.33Å; D211-K215 CarbonylContact O-C 3.52Å; D211-K215 VanDerWaalsContact O-CA 3.23Å; D211-K215 WeakPolarHBondContact O-CA 3.37Å; D211-K215 PolarHBondContact O-N 3.05Å; D211-G216 PolarHBondContact O-N 2.92Å
212	Y	93.4	Very high	93.1	Very high	67 Å²	67	94.9 Å²	94.9	26%	0.263	43%	0.428	S	S	.	.	H	α-helix	trans	-66.6	-43.9	171.2	-72.1	-95.4	0	0	0	111.9	M196 Y204 L207 S208 P209 Y210 W214	M196-Y212 HydrophobicContact CB-CD1 3.86Å; M196-Y212 HydrophobicContact CB-CE1 3.64Å; M196-Y212 HydrophobicContact CG-CD1 4.39Å; M196-Y212 HydrophobicContact CG-CE1 4.2Å; M196-Y212 WeakPolarHBondContact O-CE1 3.31Å; M196-Y212 HydrophobicContact SD-CD1 4.39Å; M196-Y212 HydrophobicContact SD-CG 4.46Å; Y204-Y212 WeakPolarHBondContact CA-OH 3.31Å; Y204-Y212 WeakPolarHBondContact CB-OH 3.41Å; Y204-Y212 AromaticContact CD2-CE2 3.93Å; Y204-Y212 HydrophobicContact CD2-CE2 3.93Å; Y204-Y212 AromaticContact CD2-CZ 3.87Å; Y204-Y212 PolarHBondContact N-OH 3.42Å; L207-Y212 HydrophobicContact CB-CE2 3.91Å; L207-Y212 HydrophobicContact CD1-CE2 4.38Å; S208-Y212 WeakPolarHBondContact O-CD2 3.29Å; P209-Y212 WeakPolarHBondContact O-CB 3.47Å; P209-Y212 PolarHBondContact O-N 3.09Å; Y210-Y212 PolarHBondContact O-N 3.38Å; Y212-W214 VanDerWaalsContact C-N 3.31Å; Y212-W214 PolarHBondContact O-N 2.79Å
213	V	93.5	Very high	93	Very high	104 Å²	104	95.6 Å²	95.6	63%	0.63	43%	0.428	S	S	*	.	H	α-helix	trans	-65.5	-38.6	179.7	179.6	0	0	0	0	111	P209 Y210	P209-V213 PolarHBondContact O-N 2.8Å; Y210-V213 PolarHBondContact O-N 3.07Å
214	W	94.6	Very high	92.9	Very high	32 Å²	32	101 Å²	101	12%	0.121	45%	0.45	C	S	.	.	H	α-helix	trans	-102.1	5.1	-175.5	-61.1	-25.9	0	0	0	114.3	R51 G52 P53 Y210 Y212 G216 K217 Y218	R51-W214 HydrophobicContact CB-CH2 3.77Å; R51-W214 HydrophobicContact CB-CZ3 4.32Å; R51-W214 HydrophobicContact CG-CH2 3.45Å; R51-W214 VanDerWaalsContact CG-CH2 3.45Å; R51-W214 HydrophobicContact CG-CZ3 3.5Å; G52-W214 VanDerWaalsContact CA-CZ2 3.48Å; P53-W214 VanDerWaalsContact CD-CD1 3.49Å; Y210-W214 AromaticContact CD1-CH2 3.67Å; Y210-W214 HydrophobicContact CD1-CH2 3.67Å; Y210-W214 AromaticContact CD1-CZ2 3.75Å; Y210-W214 HydrophobicContact CD1-CZ2 3.75Å; Y210-W214 HydrophobicContact CD1-CZ3 4.3Å; Y210-W214 AromaticContact CG-CH2 3.99Å; Y210-W214 HydrophobicContact CG-CH2 3.99Å; Y210-W214 HydrophobicContact CG-CZ2 4.44Å; Y210-W214 HydrophobicContact CG-CZ3 4.2Å; Y210-W214 WeakPolarHBondContact O-CB 3.48Å; Y210-W214 PolarHBondContact O-N 3.35Å; Y212-W214 VanDerWaalsContact C-N 3.31Å; Y212-W214 PolarHBondContact O-N 2.79Å; W214-G216 PolarHBondContact O-N 3.44Å; W214-G216 VanDerWaalsContact O-N 3.14Å; W214-K217 WeakPolarHBondContact O-CB 3.49Å; W214-K217 PolarHBondContact O-N 3.46Å; W214-Y218 HydrophobicContact CB-CD2 4.04Å; W214-Y218 HydrophobicContact CG-CD2 4.27Å
215	K	93.3	Very high	93	Very high	90 Å²	90	97.7 Å²	97.7	39%	0.391	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	34.9	174.3	-55.8	164	153.6	-158.4	0	112.6	W192 E193 D211 K217	W192-K215 WeakPolarHBondContact CB-O 3.24Å; E193-K215 HydrophobicContact CG-CB 3.94Å; E193-K215 HydrophobicContact CG-CD 3.8Å; E193-K215 HydrophobicContact CG-CG 3.8Å; E193-K215 WeakPolarHBondContact OE1-CD 3.27Å; E193-K215 WeakPolarHBondContact OE1-CE 3.45Å; E193-K215 IonicContact OE1-NZ 3.82Å; E193-K215 PolarHBondContact OE1-NZ 3.24Å; E193-K215 WeakPolarHBondContact OE2-CE 3.32Å; E193-K215 IonicContact OE2-NZ 3.69Å; E193-K215 PolarHBondContact OE2-NZ 2.95Å; D211-K215 CarbonylContact O-C 3.52Å; D211-K215 VanDerWaalsContact O-CA 3.23Å; D211-K215 WeakPolarHBondContact O-CA 3.37Å; D211-K215 PolarHBondContact O-N 3.05Å; K215-K217 PolarHBondContact O-N 2.72Å
216	G	90.4	Very high	92.8	Very high	34 Å²	34	91 Å²	91	35%	0.351	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	7.2	-177.2	0	0	0	0	0	116	D211 W214	D211-G216 PolarHBondContact O-N 2.92Å; W214-G216 PolarHBondContact O-N 3.44Å; W214-G216 VanDerWaalsContact O-N 3.14Å
217	K	92.4	Very high	92.9	Very high	140 Å²	140	84.5 Å²	84.5	61%	0.609	40%	0.402	S	S	*	.	S	Bend	trans	-74.4	-27.5	-179.5	-68.1	-170.8	174.4	-167.2	0	113.8	W214 K215	W214-K217 WeakPolarHBondContact O-CB 3.49Å; W214-K217 PolarHBondContact O-N 3.46Å; K215-K217 PolarHBondContact O-N 2.72Å
218	Y	93	Very high	92.8	Very high	78 Å²	78	88.3 Å²	88.3	31%	0.306	42%	0.419	S	S	.	.			trans	-127.2	136.4	-175	-59.8	-85.5	0	0	0	109.6	P53 A133 W214	P53-Y218 HydrophobicContact CB-CD2 4.32Å; P53-Y218 HydrophobicContact CB-CE1 4.29Å; P53-Y218 HydrophobicContact CB-CE2 3.63Å; P53-Y218 HydrophobicContact CG-CD2 4.1Å; P53-Y218 HydrophobicContact CG-CE2 3.76Å; A133-Y218 HydrophobicContact CB-CD1 3.93Å; A133-Y218 HydrophobicContact CB-CE1 3.57Å; W214-Y218 HydrophobicContact CB-CD2 4.04Å; W214-Y218 HydrophobicContact CG-CD2 4.27Å
219	R	85.8	Confident	92.7	Very high	270 Å²	270	93.2 Å²	93.2	100%	1.019	43%	0.434	S	S	*	.			trans	-109.6	0	179.8	-168.1	172.4	-178.7	178.1	0	110.7	R51	R51-R219 PolarHBondContact NE-OXT 3.48Å; R51-R219 PolarHBondContact NH2-OXT 3.42Å

Retrieved 219 of 219 residues in 242 ms (Link to these results)

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