A0A023IKL2_RAT Loading...

RT1-Bb

Involved in the presentation of foreign antigens to the immune system.

AlphaFold DB , UniProt , Accession A0A023IKL2, Species RAT (Rattus norvegicus, Rat), Gene LOC688090, Length 263 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	41.6	Very low	44.5	Very low	245 Å²	245	143.3 Å²	143.3	100%	1.207	80%	0.798	S	S	*	*				0	109.9	0	-74.5	173	-174	0	0	108
2	A	35.5	Very low	45.1	Very low	104 Å²	104	137 Å²	137	86%	0.86	78%	0.778	S	S	*	*			trans	-142.1	117.7	162.6	0	0	0	0	0	105.5
3	L	39	Very low	45.7	Very low	167 Å²	167	131.2 Å²	131.2	87%	0.874	76%	0.758	S	S	*	*			trans	-66.6	144.2	-169.7	-90.8	84.3	0	0	0	112.2
4	Q	43.3	Very low	46.3	Very low	184 Å²	184	128.1 Å²	128.1	86%	0.86	74%	0.741	S	S	*	*			trans	-58.9	136.7	156.5	-83.8	162	-49.6	0	0	111.1
5	T	40.1	Very low	46.8	Very low	133 Å²	133	125.9 Å²	125.9	82%	0.816	73%	0.73	S	S	*	*			trans	-132.9	118.4	146.3	40.8	0	0	0	0	108.2
6	P	41.7	Very low	47.3	Very low	97 Å²	97	123.2 Å²	123.2	63%	0.63	72%	0.716	S	S	*	*			trans	-90.3	110	173.7	34.5	-27.8	0	0	0	108.4	F8	P6-F8 VanDerWaalsContact C-N 3.26Å; P6-F8 HydrophobicContact CB-CD2 3.64Å; P6-F8 HydrophobicContact CB-CE2 3.66Å; P6-F8 HydrophobicContact CG-CD2 4.23Å; P6-F8 HydrophobicContact CG-CE2 4.44Å; P6-F8 PolarHBondContact O-N 3.27Å
7	S	46.1	Very low	47.4	Very low	106 Å²	106	123.2 Å²	123.2	74%	0.741	71%	0.712	S	S	*	*			trans	-81.3	72.5	179.1	-148.9	0	0	0	0	110.4	L9	S7-L9 PolarHBondContact O-N 2.97Å
8	F	47.6	Very low	47.7	Very low	174 Å²	174	123.5 Å²	123.5	76%	0.763	71%	0.708	S	S	*	*			trans	-84.6	41.3	174.1	-77	-73.2	0	0	0	112.6	P6	P6-F8 VanDerWaalsContact C-N 3.26Å; P6-F8 HydrophobicContact CB-CD2 3.64Å; P6-F8 HydrophobicContact CB-CE2 3.66Å; P6-F8 HydrophobicContact CG-CD2 4.23Å; P6-F8 HydrophobicContact CG-CE2 4.44Å; P6-F8 PolarHBondContact O-N 3.27Å
9	L	52.6	Low	48	Very low	143 Å²	143	122.5 Å²	122.5	75%	0.749	70%	0.704	S	S	*	*			trans	-109.1	13.2	-174.7	-72.9	177.8	0	0	0	115.6	S7	S7-L9 PolarHBondContact O-N 2.97Å
10	L	50.3	Low	48	Very low	136 Å²	136	123.3 Å²	123.3	71%	0.712	71%	0.705	S	S	*	*	S	Bend	trans	-112.3	-16.3	-175.7	-71.7	165.4	0	0	0	118.3
11	P	52.3	Low	48.1	Very low	87 Å²	87	121.1 Å²	121.1	57%	0.565	70%	0.697	S	S	*	*	H	α-helix	trans	-85.6	-30.2	178.6	31	-30.3	0	0	0	113.1	V15	P11-V15 WeakPolarHBondContact O-CG2 3.45Å; P11-V15 PolarHBondContact O-N 2.88Å
12	A	51.1	Low	48.5	Very low	68 Å²	68	113.2 Å²	113.2	56%	0.562	67%	0.666	S	S	*	*	H	α-helix	trans	-70.7	-40.2	-176.1	0	0	0	0	0	112.5	V14 V15 V16	A12-V14 PolarHBondContact O-N 3.35Å; A12-V15 PolarHBondContact O-N 3.43Å; A12-V16 VanDerWaalsContact O-CG2 3.29Å; A12-V16 WeakPolarHBondContact O-CG2 3.16Å; A12-V16 PolarHBondContact O-N 3.38Å
13	A	52.5	Low	49.4	Very low	62 Å²	62	113.7 Å²	113.7	51%	0.512	66%	0.66	S	S	.	*	H	α-helix	trans	-66	-36.2	-179	0	0	0	0	0	112.6	L17	A13-L17 WeakPolarHBondContact O-CB 3.43Å; A13-L17 PolarHBondContact O-N 3.32Å
14	V	54.5	Low	49.9	Very low	87 Å²	87	109 Å²	109	53%	0.527	65%	0.652	S	S	.	*	H	α-helix	trans	-72.2	-37.4	179.3	-178	0	0	0	0	111.3	A12 L17 M18	A12-V14 PolarHBondContact O-N 3.35Å; V14-L17 PolarHBondContact O-N 2.99Å; V14-M18 VanDerWaalsContact O-CG 3.27Å; V14-M18 WeakPolarHBondContact O-CG 3.34Å; V14-M18 PolarHBondContact O-N 2.94Å; V14-M18 VanDerWaalsContact O-N 3.1Å
15	V	54.5	Low	50.5	Low	95 Å²	95	106.5 Å²	106.5	58%	0.576	65%	0.65	S	S	*	*	H	α-helix	trans	-67.3	-41.3	175.4	175.5	0	0	0	0	111	P11 A12 L17 M18 V19	P11-V15 WeakPolarHBondContact O-CG2 3.45Å; P11-V15 PolarHBondContact O-N 2.88Å; A12-V15 PolarHBondContact O-N 3.43Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.02Å; V15-M18 PolarHBondContact O-N 3.04Å; V15-V19 VanDerWaalsContact O-CG2 3.32Å; V15-V19 WeakPolarHBondContact O-CG2 3.28Å; V15-V19 PolarHBondContact O-N 3.41Å; V15-V19 VanDerWaalsContact O-N 3.12Å
16	V	53.9	Low	51.2	Low	83 Å²	83	109 Å²	109	50%	0.503	65%	0.652	S	S	.	*	H	α-helix	trans	-65.7	-36.9	176.5	175.3	0	0	0	0	111.6	A12 V19 L20	A12-V16 VanDerWaalsContact O-CG2 3.29Å; A12-V16 WeakPolarHBondContact O-CG2 3.16Å; A12-V16 PolarHBondContact O-N 3.38Å; V16-V19 PolarHBondContact O-N 3.45Å; V16-L20 HydrophobicContact CG1-CD1 3.86Å; V16-L20 WeakPolarHBondContact O-CG 3.36Å; V16-L20 PolarHBondContact O-N 3.19Å; V16-L20 VanDerWaalsContact O-N 3.1Å
17	L	49.1	Very low	51.9	Low	123 Å²	123	107.6 Å²	107.6	64%	0.644	66%	0.655	S	S	*	*	H	α-helix	trans	-68.7	-36	177.4	-139.3	80	0	0	0	112.6	A13 V14 V15 L20 S21	A13-L17 WeakPolarHBondContact O-CB 3.43Å; A13-L17 PolarHBondContact O-N 3.32Å; V14-L17 PolarHBondContact O-N 2.99Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.02Å; L17-L20 PolarHBondContact O-N 3.43Å; L17-S21 WeakPolarHBondContact O-CB 3.45Å; L17-S21 PolarHBondContact O-N 3.22Å; L17-S21 PolarHBondContact O-OG 2.86Å
18	M	52.8	Low	52.6	Low	129 Å²	129	113.4 Å²	113.4	64%	0.635	66%	0.661	S	S	*	*	H	α-helix	trans	-68.5	-36.3	175.4	-70.6	-92.3	-154.5	0	0	112.5	V14 V15 S21 S22	V14-M18 VanDerWaalsContact O-CG 3.27Å; V14-M18 WeakPolarHBondContact O-CG 3.34Å; V14-M18 PolarHBondContact O-N 2.94Å; V14-M18 VanDerWaalsContact O-N 3.1Å; V15-M18 PolarHBondContact O-N 3.04Å; M18-S21 WeakPolarHBondContact CA-OG 3.49Å; M18-S22 PolarHBondContact O-N 3.24Å; M18-S22 PolarHBondContact O-OG 3.39Å
19	V	52.9	Low	53.8	Low	105 Å²	105	112.5 Å²	112.5	64%	0.636	66%	0.664	S	S	*	*	H	α-helix	trans	-69.9	-35.1	176.1	174.7	0	0	0	0	111.3	V15 V16	V15-V19 VanDerWaalsContact O-CG2 3.32Å; V15-V19 WeakPolarHBondContact O-CG2 3.28Å; V15-V19 PolarHBondContact O-N 3.41Å; V15-V19 VanDerWaalsContact O-N 3.12Å; V16-V19 PolarHBondContact O-N 3.45Å
20	L	48.1	Very low	55	Low	137 Å²	137	110 Å²	110	72%	0.717	66%	0.659	S	S	*	*	H	α-helix	trans	-81.8	-15.4	177.8	-69.9	169	0	0	0	114.3	V16 L17	V16-L20 HydrophobicContact CG1-CD1 3.86Å; V16-L20 WeakPolarHBondContact O-CG 3.36Å; V16-L20 PolarHBondContact O-N 3.19Å; V16-L20 VanDerWaalsContact O-N 3.1Å; L17-L20 PolarHBondContact O-N 3.43Å
21	S	50.2	Low	56.8	Low	78 Å²	78	109.6 Å²	109.6	55%	0.545	66%	0.664	S	S	.	*	S	Bend	trans	-105.5	3.5	178.9	53	0	0	0	0	113.8	L17 M18 P23	L17-S21 WeakPolarHBondContact O-CB 3.45Å; L17-S21 PolarHBondContact O-N 3.22Å; L17-S21 PolarHBondContact O-OG 2.86Å; M18-S21 WeakPolarHBondContact CA-OG 3.49Å; S21-P23 WeakPolarHBondContact O-CD 3.05Å; S21-P23 VanDerWaalsContact O-N 3.13Å
22	S	49.7	Very low	58.6	Low	80 Å²	80	115.6 Å²	115.6	56%	0.559	68%	0.675	S	S	*	*	S	Bend	trans	-62.6	112	157.5	-60	0	0	0	0	105.7	M18 G24	M18-S22 PolarHBondContact O-N 3.24Å; M18-S22 PolarHBondContact O-OG 3.39Å; S22-G24 PolarHBondContact O-N 3.07Å
23	P	54.2	Low	60.7	Low	113 Å²	113	118.3 Å²	118.3	73%	0.734	68%	0.68	S	S	*	*			trans	-61.2	105.4	168.2	-2.5	18.5	0	0	0	102.8	S21 T25	S21-P23 WeakPolarHBondContact O-CD 3.05Å; S21-P23 VanDerWaalsContact O-N 3.13Å; P23-T25 PolarHBondContact O-N 2.89Å
24	G	51.1	Low	62.7	Low	69 Å²	69	121.3 Å²	121.3	71%	0.711	68%	0.682	S	S	*	*			trans	-50.9	108.5	158.7	0	0	0	0	0	103	S22 E26	S22-G24 PolarHBondContact O-N 3.07Å; G24-E26 PolarHBondContact O-N 3.39Å
25	T	55.3	Low	64.8	Low	132 Å²	132	119.6 Å²	119.6	81%	0.81	67%	0.672	S	S	*	*			trans	-64.4	85.7	167.1	49.9	0	0	0	0	103.2	P23 G27	P23-T25 PolarHBondContact O-N 2.89Å; T25-G27 PolarHBondContact O-N 3.26Å
26	E	54.2	Low	66.9	Low	185 Å²	185	122.2 Å²	122.2	86%	0.864	67%	0.672	S	S	*	*			trans	-51.1	99.6	159.3	-167.6	170	-174.2	0	0	102.5	G24 R28	G24-E26 PolarHBondContact O-N 3.39Å; E26-R28 PolarHBondContact O-N 3.2Å
27	G	58.1	Low	69	Low	67 Å²	67	122.4 Å²	122.4	69%	0.691	67%	0.668	S	S	*	*			trans	-60.7	95.9	-173.1	0	0	0	0	0	105.2	T25 D29	T25-G27 PolarHBondContact O-N 3.26Å; G27-D29 PolarHBondContact O-N 3.12Å
28	R	60.4	Low	71.3	Confident	229 Å²	229	122.5 Å²	122.5	86%	0.864	66%	0.663	S	S	*	*			trans	-50.9	114	179.7	-157.1	177	-166.1	168.7	3.4	105	E26 S30	E26-R28 PolarHBondContact O-N 3.2Å; R28-S30 VanDerWaalsContact C-N 3.31Å; R28-S30 WeakPolarHBondContact O-CA 3.32Å; R28-S30 PolarHBondContact O-N 2.95Å; R28-S30 PolarHBondContact O-OG 2.95Å; R28-S30 VanDerWaalsContact O-OG 3.05Å
29	D	72.2	Confident	73.5	Confident	155 Å²	155	119.6 Å²	119.6	83%	0.829	65%	0.648	S	S	*	*			trans	-51.8	99.1	-170	-156.2	10	0	0	0	107.7	G27	G27-D29 PolarHBondContact O-N 3.12Å
30	S	78.7	Confident	75.6	Confident	91 Å²	91	117.1 Å²	117.1	64%	0.636	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-76.7	129.2	-169.8	-68.4	0	0	0	0	106.1	R28 R32	R28-S30 VanDerWaalsContact C-N 3.31Å; R28-S30 WeakPolarHBondContact O-CA 3.32Å; R28-S30 PolarHBondContact O-N 2.95Å; R28-S30 PolarHBondContact O-OG 2.95Å; R28-S30 VanDerWaalsContact O-OG 3.05Å; S30-R32 PolarHBondContact O-N 3.22Å
31	P	86.3	Confident	78	Confident	126 Å²	126	113.1 Å²	113.1	82%	0.818	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-55.8	132.7	-176.8	21	-30.5	0	0	0	109.3
32	R	91.4	Very high	80.3	Confident	213 Å²	213	111.1 Å²	111.1	80%	0.804	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-75.5	131.4	175	-61.8	-175.7	-173.4	178.3	2	108.7	S30 F34	S30-R32 PolarHBondContact O-N 3.22Å; R32-F34 HydrophobicContact CB-CD2 4.45Å; R32-F34 HydrophobicContact CB-CE2 3.66Å; R32-F34 HydrophobicContact CB-CZ 4.04Å
33	D	94.4	Very high	82.6	Confident	125 Å²	125	112.1 Å²	112.1	67%	0.668	60%	0.599	S	S	*	*			trans	-106.3	137.9	176.2	-171.5	18.5	0	0	0	110.4
34	F	95.8	Very high	84.7	Confident	125 Å²	125	110.5 Å²	110.5	55%	0.548	58%	0.579	S	S	.	*			trans	-139.2	111.8	179.1	-60.2	-75.8	0	0	0	108.6	R32 Y59 N60	R32-F34 HydrophobicContact CB-CD2 4.45Å; R32-F34 HydrophobicContact CB-CE2 3.66Å; R32-F34 HydrophobicContact CB-CZ 4.04Å; F34-Y59 HydrophobicContact CB-CE2 4.39Å; F34-Y59 WeakPolarHBondContact CD1-OH 3.29Å; F34-N60 WeakPolarHBondContact CA-OD1 3.28Å
35	V	97.8	Very high	86.9	Confident	51 Å²	51	111.2 Å²	111.2	31%	0.309	57%	0.569	S	S	.	*			trans	-109.8	130.5	-173.1	-174	0	0	0	0	109.6	Q37 Y59 N60	V35-Q37 HydrophobicContact CG1-CG 3.68Å; V35-Y59 CarbonylContact O-C 3.58Å; V35-Y59 WeakPolarHBondContact O-CD2 3.43Å; V35-N60 PolarHBondContact N-OD1 3.47Å; V35-N60 WeakPolarHBondContact O-CA 3.49Å; V35-N60 PolarHBondContact O-N 3.47Å
36	Y	97.5	Very high	88.8	Confident	151 Å²	151	110.4 Å²	110.4	59%	0.592	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.6	131.2	165.6	-88.5	-81	0	0	0	109.1	Y59 Y64	Y36-Y59 AromaticContact CD1-CD2 3.84Å; Y36-Y59 HydrophobicContact CD1-CD2 3.84Å; Y36-Y59 AromaticContact CD2-CD2 3.64Å; Y36-Y59 HydrophobicContact CD2-CD2 3.64Å; Y36-Y59 AromaticContact CD2-CE2 3.81Å; Y36-Y59 HydrophobicContact CD2-CE2 3.81Å; Y36-Y59 AromaticContact CE1-CD2 3.47Å; Y36-Y59 HydrophobicContact CE1-CD2 3.47Å; Y36-Y59 VanDerWaalsContact CE1-CD2 3.47Å; Y36-Y59 HydrophobicContact CE1-CE2 4.3Å; Y36-Y59 AromaticContact CE1-CG 3.99Å; Y36-Y59 HydrophobicContact CE1-CG 3.99Å; Y36-Y59 AromaticContact CE2-CD2 3.26Å; Y36-Y59 HydrophobicContact CE2-CD2 3.26Å; Y36-Y59 AromaticContact CE2-CE2 3.26Å; Y36-Y59 HydrophobicContact CE2-CE2 3.26Å; Y36-Y59 HydrophobicContact CE2-CG 4.41Å; Y36-Y59 AromaticContact CG-CD2 3.92Å; Y36-Y59 HydrophobicContact CG-CD2 3.92Å; Y36-Y59 AromaticContact CZ-CD2 3.16Å; Y36-Y59 AromaticContact CZ-CE2 3.54Å; Y36-Y59 AromaticContact CZ-CG 3.92Å; Y36-Y64 HydrophobicContact CD1-CE1 4.31Å; Y36-Y64 AromaticContact CE1-CE1 3.94Å; Y36-Y64 HydrophobicContact CE1-CE1 3.94Å
37	Q	98.4	Very high	90.7	Very high	87 Å²	87	102.7 Å²	102.7	41%	0.407	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.7	178.4	-47	178	71.6	0	0	109.7	V35 I58 N60	V35-Q37 HydrophobicContact CG1-CG 3.68Å; Q37-I58 HydrophobicContact CB-CB 4.16Å; Q37-I58 PolarHBondContact N-O 3.2Å; Q37-I58 PolarHBondContact O-N 3.13Å; Q37-N60 PolarHBondContact NE2-O 2.98Å
38	F	98.3	Very high	92.5	Very high	124 Å²	124	100.8 Å²	100.8	54%	0.544	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124.7	171.1	171.2	-100.9	0	0	0	108.1	T55 R56 H57	F38-T55 HydrophobicContact CE2-CG2 4.31Å; F38-T55 HydrophobicContact CZ-CG2 4.14Å; F38-R56 WeakPolarHBondContact CA-O 3.27Å; F38-H57 AromaticContact CD2-CE1 3.49Å; F38-H57 VanDerWaalsContact CD2-CE1 3.49Å; F38-H57 WeakPolarHBondContact CD2-CE1 3.24Å; F38-H57 AromaticContact CD2-ND1 3.78Å; F38-H57 AromaticContact CD2-NE2 3.99Å; F38-H57 AromaticContact CE2-CE1 3.68Å; F38-H57 AromaticContact CE2-NE2 3.85Å
39	E	98.4	Very high	94.1	Very high	69 Å²	69	97.1 Å²	97.1	32%	0.322	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	115.5	174.8	-58.4	-176.6	-175.3	0	0	109.8	Q41 T55 R56 I58	E39-Q41 HydrophobicContact CB-CG 4.44Å; E39-Q41 PolarHBondContact OE2-NE2 3.47Å; E39-Q41 VanDerWaalsContact OE2-NE2 3.14Å; E39-T55 CarbonylContact O-C 3.54Å; E39-T55 VanDerWaalsContact O-CA 3.31Å; E39-T55 WeakPolarHBondContact O-CA 3.47Å; E39-R56 HydrophobicContact CB-CB 4.14Å; E39-R56 HydrophobicContact CB-CG 4.45Å; E39-R56 PolarHBondContact N-O 3.42Å; E39-R56 PolarHBondContact O-N 2.94Å; E39-I58 HydrophobicContact CG-CD1 4.09Å
40	G	98	Very high	95.3	Very high	52 Å²	52	97.6 Å²	97.6	54%	0.536	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	106.6	170.8	0	0	0	0	0	110.3
41	Q	98.4	Very high	96.2	Very high	53 Å²	53	94.2 Å²	94.2	25%	0.248	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.6	-173.2	-65.1	174.2	-35.3	0	0	110.6	E39 Y43 L53 V54	E39-Q41 HydrophobicContact CB-CG 4.44Å; E39-Q41 PolarHBondContact OE2-NE2 3.47Å; E39-Q41 VanDerWaalsContact OE2-NE2 3.14Å; Q41-Y43 HydrophobicContact CB-CE2 3.87Å; Q41-Y43 PolarHBondContact OE1-OH 2.88Å; Q41-L53 WeakPolarHBondContact O-CA 3.36Å; Q41-V54 HydrophobicContact CB-CB 4.48Å; Q41-V54 PolarHBondContact N-O 3.5Å; Q41-V54 PolarHBondContact O-N 3.28Å
42	C	98.3	Very high	96.8	Very high	37 Å²	37	92.3 Å²	92.3	25%	0.25	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	116.4	171.4	-61	0	0	0	0	109.1	Y44 C104	C42-Y44 HydrophobicContact CB-CE1 4.34Å; C42-Y44 HydrophobicContact CB-CE2 3.63Å; C42-Y44 VanDerWaalsContact CB-CZ 3.48Å; C42-Y44 WeakPolarHBondContact CB-OH 3.15Å; C42-Y44 WeakPolarHBondContact O-CD2 3.3Å; C42-Y44 WeakPolarHBondContact O-CE2 3.07Å; C42-C104 HydrophobicContact CB-CB 3.59Å; C42-C104 WeakPolarHBondContact CB-SG 3.42Å; C42-C104 WeakPolarHBondContact SG-CA 3.02Å; C42-C104 WeakPolarHBondContact SG-CB 3.49Å; C42-C104 CovalentContact SG-SG 2.03Å; C42-C104 PolarHBondContact SG-SG 2.83Å
43	Y	98.2	Very high	97.1	Very high	101 Å²	101	82.5 Å²	82.5	40%	0.396	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.8	175.8	-58.6	-84.5	0	0	0	109.5	Q41 M51 R52 V54	Q41-Y43 HydrophobicContact CB-CE2 3.87Å; Q41-Y43 PolarHBondContact OE1-OH 2.88Å; Y43-M51 CarbonylContact O-C 3.51Å; Y43-M51 VanDerWaalsContact O-CA 3.26Å; Y43-M51 WeakPolarHBondContact O-CA 3.47Å; Y43-R52 HydrophobicContact CD2-CB 4.39Å; Y43-R52 HydrophobicContact CD2-CG 4.49Å; Y43-R52 PolarHBondContact N-O 3.02Å; Y43-R52 PolarHBondContact O-N 3.01Å; Y43-V54 HydrophobicContact CD2-CG2 4.25Å; Y43-V54 HydrophobicContact CE2-CB 4.13Å; Y43-V54 HydrophobicContact CE2-CG2 3.79Å
44	Y	97.3	Very high	97.4	Very high	78 Å²	78	76.5 Å²	76.5	31%	0.306	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.2	-178.3	-55.6	-83.4	0	0	0	110.1	C42 M51 C104 Y108	C42-Y44 HydrophobicContact CB-CE1 4.34Å; C42-Y44 HydrophobicContact CB-CE2 3.63Å; C42-Y44 VanDerWaalsContact CB-CZ 3.48Å; C42-Y44 WeakPolarHBondContact CB-OH 3.15Å; C42-Y44 WeakPolarHBondContact O-CD2 3.3Å; C42-Y44 WeakPolarHBondContact O-CE2 3.07Å; Y44-M51 HydrophobicContact CD1-CG 3.81Å; Y44-M51 HydrophobicContact CD1-SD 3.91Å; Y44-M51 HydrophobicContact CE1-CG 4.2Å; Y44-M51 HydrophobicContact CE1-SD 3.79Å; Y44-C104 HydrophobicContact CE1-CB 4.09Å; Y44-C104 WeakPolarHBondContact OH-CA 3.47Å; Y44-C104 PolarHBondContact OH-O 2.81Å; Y44-Y108 AromaticContact CD1-CD2 3.4Å; Y44-Y108 HydrophobicContact CD1-CD2 3.4Å; Y44-Y108 VanDerWaalsContact CD1-CD2 3.4Å; Y44-Y108 HydrophobicContact CD1-CE2 4.03Å; Y44-Y108 AromaticContact CD1-CG 3.9Å; Y44-Y108 HydrophobicContact CD1-CG 3.9Å; Y44-Y108 AromaticContact CD2-CD2 3.82Å; Y44-Y108 HydrophobicContact CD2-CD2 3.82Å; Y44-Y108 HydrophobicContact CD2-CE2 4.22Å; Y44-Y108 AromaticContact CE1-CD2 3.62Å; Y44-Y108 HydrophobicContact CE1-CD2 3.62Å; Y44-Y108 AromaticContact CE1-CG 3.87Å; Y44-Y108 HydrophobicContact CE1-CG 3.87Å; Y44-Y108 AromaticContact CE2-CD2 4Å; Y44-Y108 HydrophobicContact CE2-CD2 4Å; Y44-Y108 AromaticContact CG-CD2 3.52Å; Y44-Y108 HydrophobicContact CG-CD2 3.52Å; Y44-Y108 AromaticContact CG-CE2 3.81Å; Y44-Y108 HydrophobicContact CG-CE2 3.81Å; Y44-Y108 HydrophobicContact CG-CG 4.45Å; Y44-Y108 AromaticContact CZ-CD2 3.9Å
45	T	97.1	Very high	97.5	Very high	84 Å²	84	70.7 Å²	70.7	52%	0.515	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.7	173.4	-57.3	0	0	0	0	109.1	R50	T45-R50 PolarHBondContact N-O 3.36Å; T45-R50 PolarHBondContact O-N 2.94Å
46	N	95.4	Very high	97.5	Very high	115 Å²	115	70.5 Å²	70.5	62%	0.615	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	58.7	-174.4	-160.2	15.7	0	0	0	112.3	Q49	N46-Q49 VanDerWaalsContact ND2-CD 3.27Å; N46-Q49 PolarHBondContact ND2-NE2 3.46Å; N46-Q49 PolarHBondContact ND2-OE1 2.98Å; N46-Q49 WeakPolarHBondContact O-CB 3.34Å; N46-Q49 VanDerWaalsContact O-CG 3.31Å; N46-Q49 WeakPolarHBondContact O-CG 3.39Å; N46-Q49 PolarHBondContact O-N 3.19Å
47	G	93.4	Very high	97.6	Very high	23 Å²	23	64.7 Å²	64.7	24%	0.237	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	-131.4	-172.6	0	0	0	0	0	112
48	T	96.3	Very high	97.6	Very high	28 Å²	28	61.4 Å²	61.4	17%	0.172	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	14.3	178.6	60.3	0	0	0	0	113.4	M51 R105 Y108 E109	T48-M51 HydrophobicContact CG2-SD 3.83Å; T48-R105 HydrophobicContact CG2-CG 4.27Å; T48-R105 PolarHBondContact O-NH1 3.5Å; T48-R105 PolarHBondContact OG1-NH1 3.46Å; T48-Y108 HydrophobicContact CG2-CD1 3.38Å; T48-Y108 HydrophobicContact CG2-CE1 4.05Å; T48-Y108 HydrophobicContact CG2-CG 3.76Å; T48-E109 WeakPolarHBondContact CB-OE1 3.34Å; T48-E109 HydrophobicContact CG2-CG 3.84Å; T48-E109 WeakPolarHBondContact CG2-OE1 3.4Å; T48-E109 PolarHBondContact OG1-OE1 3.1Å
49	Q	95.1	Very high	97.6	Very high	152 Å²	152	58.1 Å²	58.1	71%	0.71	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-45.3	177.2	-69.7	-177.8	15	0	0	111.8	N46	N46-Q49 VanDerWaalsContact ND2-CD 3.27Å; N46-Q49 PolarHBondContact ND2-NE2 3.46Å; N46-Q49 PolarHBondContact ND2-OE1 2.98Å; N46-Q49 WeakPolarHBondContact O-CB 3.34Å; N46-Q49 VanDerWaalsContact O-CG 3.31Å; N46-Q49 WeakPolarHBondContact O-CG 3.39Å; N46-Q49 PolarHBondContact O-N 3.19Å
50	R	97.2	Very high	97.5	Very high	164 Å²	164	57.6 Å²	57.6	62%	0.619	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	121.2	172	-178.4	178.9	-177.7	-178.3	0.8	108.9	T45	T45-R50 PolarHBondContact N-O 3.36Å; T45-R50 PolarHBondContact O-N 2.94Å
51	M	97.9	Very high	97.4	Very high	20 Å²	20	66.7 Å²	66.7	10%	0.099	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.2	176.7	-61.8	-178.9	-57.1	0	0	109.8	Y43 Y44 T48 L100 C104 R105	Y43-M51 CarbonylContact O-C 3.51Å; Y43-M51 VanDerWaalsContact O-CA 3.26Å; Y43-M51 WeakPolarHBondContact O-CA 3.47Å; Y44-M51 HydrophobicContact CD1-CG 3.81Å; Y44-M51 HydrophobicContact CD1-SD 3.91Å; Y44-M51 HydrophobicContact CE1-CG 4.2Å; Y44-M51 HydrophobicContact CE1-SD 3.79Å; T48-M51 HydrophobicContact CG2-SD 3.83Å; M51-L100 HydrophobicContact CB-CD1 3.85Å; M51-L100 HydrophobicContact CE-CG 4.43Å; M51-C104 HydrophobicContact SD-CB 4.47Å; M51-R105 HydrophobicContact CE-CB 3.84Å; M51-R105 HydrophobicContact CE-CG 4.3Å; M51-R105 VanDerWaalsContact CE-CZ 3.46Å; M51-R105 HydrophobicContact SD-CB 4.11Å
52	R	98.4	Very high	97.4	Very high	87 Å²	87	68.8 Å²	68.8	33%	0.328	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.9	171.8	-178.9	-175.7	174.2	-170.2	-0.7	109.4	Y43 V54 D68 S69 D70	Y43-R52 HydrophobicContact CD2-CB 4.39Å; Y43-R52 HydrophobicContact CD2-CG 4.49Å; Y43-R52 PolarHBondContact N-O 3.02Å; Y43-R52 PolarHBondContact O-N 3.01Å; R52-V54 HydrophobicContact CG-CG2 4.11Å; R52-D68 IonicContact CZ-OD1 3.49Å; R52-D68 IonicContact CZ-OD2 2.78Å; R52-D68 IonicContact NE-OD1 2.75Å; R52-D68 PolarHBondContact NE-OD1 2.98Å; R52-D68 IonicContact NE-OD2 3.05Å; R52-D68 PolarHBondContact NE-OD2 3.37Å; R52-D68 IonicContact NH2-OD1 3.52Å; R52-D68 IonicContact NH2-OD2 3.38Å; R52-D68 PolarHBondContact NH2-OD2 3Å; R52-S69 WeakPolarHBondContact CA-OG 3.48Å; R52-D70 WeakPolarHBondContact CD-OD2 3.44Å; R52-D70 IonicContact NE-OD2 3.47Å
53	L	98.6	Very high	97.4	Very high	6 Å²	6	68.7 Å²	68.7	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.2	173.5	170.7	62.6	0	0	0	108.6	Q41 T55 Y67 S69 E99 L100	Q41-L53 WeakPolarHBondContact O-CA 3.36Å; L53-T55 HydrophobicContact CD1-CG2 4.12Å; L53-T55 HydrophobicContact CG-CG2 4.39Å; L53-Y67 HydrophobicContact CD2-CE1 4.12Å; L53-Y67 HydrophobicContact CG-CD1 4.45Å; L53-Y67 HydrophobicContact CG-CE1 4.28Å; L53-S69 PolarHBondContact N-OG 3.4Å; L53-S69 PolarHBondContact O-N 3.35Å; L53-S69 PolarHBondContact O-OG 3.1Å; L53-E99 HydrophobicContact CD2-CB 3.71Å; L53-L100 HydrophobicContact CB-CB 4.49Å; L53-L100 HydrophobicContact CB-CD1 3.73Å
54	V	98.8	Very high	97.4	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122	171.9	-178.3	0	0	0	0	108.5	Q41 Y43 R52 R56 R66 Y67	Q41-V54 HydrophobicContact CB-CB 4.48Å; Q41-V54 PolarHBondContact N-O 3.5Å; Q41-V54 PolarHBondContact O-N 3.28Å; Y43-V54 HydrophobicContact CD2-CG2 4.25Å; Y43-V54 HydrophobicContact CE2-CB 4.13Å; Y43-V54 HydrophobicContact CE2-CG2 3.79Å; R52-V54 HydrophobicContact CG-CG2 4.11Å; V54-R56 HydrophobicContact CG1-CG 3.94Å; V54-R66 HydrophobicContact CG1-CG 3.82Å; V54-Y67 CarbonylContact C-O 3.56Å; V54-Y67 VanDerWaalsContact CA-O 3.32Å; V54-Y67 WeakPolarHBondContact CA-O 3.34Å
55	T	98.6	Very high	97.5	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.1	169.5	73.8	0	0	0	0	109.2	F38 E39 L53 R66 Y67 T96	F38-T55 HydrophobicContact CE2-CG2 4.31Å; F38-T55 HydrophobicContact CZ-CG2 4.14Å; E39-T55 CarbonylContact O-C 3.54Å; E39-T55 VanDerWaalsContact O-CA 3.31Å; E39-T55 WeakPolarHBondContact O-CA 3.47Å; L53-T55 HydrophobicContact CD1-CG2 4.12Å; L53-T55 HydrophobicContact CG-CG2 4.39Å; T55-R66 CarbonylContact O-C 3.57Å; T55-R66 VanDerWaalsContact O-CA 3.22Å; T55-R66 WeakPolarHBondContact O-CA 3.32Å; T55-R66 WeakPolarHBondContact O-CG 3.46Å; T55-Y67 PolarHBondContact N-O 2.93Å; T55-Y67 PolarHBondContact O-N 3.44Å; T55-Y67 WeakPolarHBondContact OG1-CB 3.36Å; T55-T96 HydrophobicContact CG2-CG2 4.42Å
56	R	98.6	Very high	97.6	Very high	48 Å²	48	60 Å²	60	18%	0.181	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.2	-177.3	-51.3	-178.3	176.3	-102.6	-1.9	109.5	F38 E39 V54 I58 E63	F38-R56 WeakPolarHBondContact CA-O 3.27Å; E39-R56 HydrophobicContact CB-CB 4.14Å; E39-R56 HydrophobicContact CB-CG 4.45Å; E39-R56 PolarHBondContact N-O 3.42Å; E39-R56 PolarHBondContact O-N 2.94Å; V54-R56 HydrophobicContact CG1-CG 3.94Å; R56-I58 HydrophobicContact CB-CD1 4.28Å; R56-I58 HydrophobicContact CB-CG1 4.33Å; R56-E63 HydrophobicContact CB-CG 4.16Å; R56-E63 WeakPolarHBondContact CB-OE1 3.45Å; R56-E63 VanDerWaalsContact CG-OE1 3.3Å; R56-E63 WeakPolarHBondContact CG-OE1 3.32Å; R56-E63 IonicContact CZ-OE2 2.62Å; R56-E63 IonicContact NH1-OE1 3.86Å; R56-E63 PolarHBondContact NH1-OE1 3.24Å; R56-E63 IonicContact NH1-OE2 2.9Å; R56-E63 PolarHBondContact NH1-OE2 2.92Å
57	H	98.4	Very high	97.7	Very high	29 Å²	29	54.8 Å²	54.8	13%	0.134	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	116.9	172.8	-62.7	-91.5	0	0	0	108.9	F38 E63 Y64 A65 Y74 W88	F38-H57 AromaticContact CD2-CE1 3.49Å; F38-H57 VanDerWaalsContact CD2-CE1 3.49Å; F38-H57 WeakPolarHBondContact CD2-CE1 3.24Å; F38-H57 AromaticContact CD2-ND1 3.78Å; F38-H57 AromaticContact CD2-NE2 3.99Å; F38-H57 AromaticContact CE2-CE1 3.68Å; F38-H57 AromaticContact CE2-NE2 3.85Å; H57-E63 WeakPolarHBondContact O-CA 3.47Å; H57-Y64 HydrophobicContact CB-CE1 3.86Å; H57-Y64 HydrophobicContact CB-CE2 3.95Å; H57-Y64 VanDerWaalsContact O-CD1 3.29Å; H57-Y64 WeakPolarHBondContact O-CD1 3.35Å; H57-Y64 PolarHBondContact O-N 3.42Å; H57-A65 WeakPolarHBondContact CB-O 3.33Å; H57-A65 PolarHBondContact N-O 2.97Å; H57-Y74 AromaticContact NE2-CE1 3.83Å; H57-W88 HydrophobicContact CB-CH2 3.97Å; H57-W88 HydrophobicContact CB-CZ3 4.23Å; H57-W88 AromaticContact CD2-CH2 3.7Å; H57-W88 AromaticContact CD2-CZ3 3.42Å; H57-W88 VanDerWaalsContact CD2-CZ3 3.42Å; H57-W88 WeakPolarHBondContact CD2-CZ3 3.42Å; H57-W88 AromaticContact CE1-CH2 3.78Å; H57-W88 AromaticContact CG-CH2 3.46Å; H57-W88 VanDerWaalsContact CG-CH2 3.46Å; H57-W88 AromaticContact CG-CZ3 3.66Å; H57-W88 AromaticContact ND1-CH2 3.53Å; H57-W88 AromaticContact NE2-CH2 3.91Å; H57-W88 AromaticContact NE2-CZ3 3.72Å
58	I	98.6	Very high	98	Very high	17 Å²	17	54.2 Å²	54.2	9%	0.087	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130	-169.5	-57.2	161.2	0	0	0	108.7	Q37 E39 R56 E62 E63	Q37-I58 HydrophobicContact CB-CB 4.16Å; Q37-I58 PolarHBondContact N-O 3.2Å; Q37-I58 PolarHBondContact O-N 3.13Å; E39-I58 HydrophobicContact CG-CD1 4.09Å; R56-I58 HydrophobicContact CB-CD1 4.28Å; R56-I58 HydrophobicContact CB-CG1 4.33Å; I58-E62 WeakPolarHBondContact CA-O 3.45Å; I58-E63 HydrophobicContact CG1-CB 4.02Å; I58-E63 HydrophobicContact CG1-CG 4.02Å
59	Y	98	Very high	98.1	Very high	56 Å²	56	54.1 Å²	54.1	22%	0.22	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.5	170.6	-178.3	-118.2	0	0	0	109.2	F34 V35 Y36 R61 E62 L80	F34-Y59 HydrophobicContact CB-CE2 4.39Å; F34-Y59 WeakPolarHBondContact CD1-OH 3.29Å; V35-Y59 CarbonylContact O-C 3.58Å; V35-Y59 WeakPolarHBondContact O-CD2 3.43Å; Y36-Y59 AromaticContact CD1-CD2 3.84Å; Y36-Y59 HydrophobicContact CD1-CD2 3.84Å; Y36-Y59 AromaticContact CD2-CD2 3.64Å; Y36-Y59 HydrophobicContact CD2-CD2 3.64Å; Y36-Y59 AromaticContact CD2-CE2 3.81Å; Y36-Y59 HydrophobicContact CD2-CE2 3.81Å; Y36-Y59 AromaticContact CE1-CD2 3.47Å; Y36-Y59 HydrophobicContact CE1-CD2 3.47Å; Y36-Y59 VanDerWaalsContact CE1-CD2 3.47Å; Y36-Y59 HydrophobicContact CE1-CE2 4.3Å; Y36-Y59 AromaticContact CE1-CG 3.99Å; Y36-Y59 HydrophobicContact CE1-CG 3.99Å; Y36-Y59 AromaticContact CE2-CD2 3.26Å; Y36-Y59 HydrophobicContact CE2-CD2 3.26Å; Y36-Y59 AromaticContact CE2-CE2 3.26Å; Y36-Y59 HydrophobicContact CE2-CE2 3.26Å; Y36-Y59 HydrophobicContact CE2-CG 4.41Å; Y36-Y59 AromaticContact CG-CD2 3.92Å; Y36-Y59 HydrophobicContact CG-CD2 3.92Å; Y36-Y59 AromaticContact CZ-CD2 3.16Å; Y36-Y59 AromaticContact CZ-CE2 3.54Å; Y36-Y59 AromaticContact CZ-CG 3.92Å; Y59-R61 PolarHBondContact O-N 3.12Å; Y59-E62 PolarHBondContact N-O 3.4Å; Y59-E62 PolarHBondContact O-N 3.36Å; Y59-L80 HydrophobicContact CD1-CD2 3.94Å; Y59-L80 HydrophobicContact CG-CD2 4.29Å
60	N	96.7	Very high	98.2	Very high	58 Å²	58	51.3 Å²	51.3	31%	0.31	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	-94.5	-164.7	-62.3	-38.8	0	0	0	111.1	F34 V35 Q37	F34-N60 WeakPolarHBondContact CA-OD1 3.28Å; V35-N60 PolarHBondContact N-OD1 3.47Å; V35-N60 WeakPolarHBondContact O-CA 3.49Å; V35-N60 PolarHBondContact O-N 3.47Å; Q37-N60 PolarHBondContact NE2-O 2.98Å
61	R	96.6	Very high	98.3	Very high	243 Å²	243	47.6 Å²	47.6	92%	0.917	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.2	6.9	178.6	-59.8	-178.5	-179.7	179.4	-0.3	112.6	Y59	Y59-R61 PolarHBondContact O-N 3.12Å
62	E	98.1	Very high	98.3	Very high	96 Å²	96	47.3 Å²	47.3	45%	0.449	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	114.3	-177.7	-171	-177.4	151.5	0	0	109.6	I58 Y59 Y64 T78	I58-E62 WeakPolarHBondContact CA-O 3.45Å; Y59-E62 PolarHBondContact N-O 3.4Å; Y59-E62 PolarHBondContact O-N 3.36Å; E62-Y64 PolarHBondContact O-N 3.43Å; E62-T78 HydrophobicContact CG-CG2 4.03Å; E62-T78 WeakPolarHBondContact OE1-CB 3.39Å; E62-T78 WeakPolarHBondContact OE1-CG2 3.42Å; E62-T78 PolarHBondContact OE1-OG1 3.04Å
63	E	98.4	Very high	98.3	Very high	35 Å²	35	46 Å²	46	16%	0.164	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	107.7	170.4	-167.8	-172.6	171.5	0	0	108.9	R56 H57 I58 R66 L77	R56-E63 HydrophobicContact CB-CG 4.16Å; R56-E63 WeakPolarHBondContact CB-OE1 3.45Å; R56-E63 VanDerWaalsContact CG-OE1 3.3Å; R56-E63 WeakPolarHBondContact CG-OE1 3.32Å; R56-E63 IonicContact CZ-OE2 2.62Å; R56-E63 IonicContact NH1-OE1 3.86Å; R56-E63 PolarHBondContact NH1-OE1 3.24Å; R56-E63 IonicContact NH1-OE2 2.9Å; R56-E63 PolarHBondContact NH1-OE2 2.92Å; H57-E63 WeakPolarHBondContact O-CA 3.47Å; I58-E63 HydrophobicContact CG1-CB 4.02Å; I58-E63 HydrophobicContact CG1-CG 4.02Å; E63-R66 VanDerWaalsContact CD-NH2 3.26Å; E63-R66 WeakPolarHBondContact OE1-CB 3.48Å; E63-R66 IonicContact OE1-CZ 3.43Å; E63-R66 VanDerWaalsContact OE1-CZ 3.31Å; E63-R66 IonicContact OE1-NE 3.67Å; E63-R66 PolarHBondContact OE1-NE 2.94Å; E63-R66 IonicContact OE1-NH2 2.93Å; E63-R66 PolarHBondContact OE1-NH2 3.36Å; E63-R66 VanDerWaalsContact OE1-NH2 3.11Å; E63-R66 IonicContact OE2-CZ 3.71Å; E63-R66 IonicContact OE2-NE 3.42Å; E63-R66 IonicContact OE2-NH2 3.61Å; E63-R66 PolarHBondContact OE2-NH2 2.97Å; E63-L77 HydrophobicContact CB-CD1 4.13Å; E63-L77 VanDerWaalsContact CD-CD1 3.4Å; E63-L77 HydrophobicContact CG-CD1 3.66Å; E63-L77 WeakPolarHBondContact O-CB 3.48Å
64	Y	98.4	Very high	98.3	Very high	21 Å²	21	46.4 Å²	46.4	8%	0.082	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-26.3	-172.2	66.8	-99.2	0	0	0	112.8	Y36 H57 E62 L77 T78 L80 G81 W88	Y36-Y64 HydrophobicContact CD1-CE1 4.31Å; Y36-Y64 AromaticContact CE1-CE1 3.94Å; Y36-Y64 HydrophobicContact CE1-CE1 3.94Å; H57-Y64 HydrophobicContact CB-CE1 3.86Å; H57-Y64 HydrophobicContact CB-CE2 3.95Å; H57-Y64 VanDerWaalsContact O-CD1 3.29Å; H57-Y64 WeakPolarHBondContact O-CD1 3.35Å; H57-Y64 PolarHBondContact O-N 3.42Å; E62-Y64 PolarHBondContact O-N 3.43Å; Y64-L77 PolarHBondContact O-N 2.97Å; Y64-T78 PolarHBondContact O-N 3.32Å; Y64-L80 HydrophobicContact CD1-CD2 4.22Å; Y64-L80 HydrophobicContact CG-CD2 4.16Å; Y64-L80 HydrophobicContact CG-CG 4.33Å; Y64-G81 VanDerWaalsContact CD2-CA 3.5Å; Y64-G81 WeakPolarHBondContact O-CA 3.48Å; Y64-W88 AromaticContact CE2-CH2 3.87Å; Y64-W88 HydrophobicContact CE2-CH2 3.87Å; Y64-W88 HydrophobicContact CE2-CZ3 4.41Å
65	A	98.6	Very high	98.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	150	178.3	0	0	0	0	0	111.7	H57 R75 W88	H57-A65 WeakPolarHBondContact CB-O 3.33Å; H57-A65 PolarHBondContact N-O 2.97Å; A65-R75 VanDerWaalsContact CA-O 3.32Å; A65-R75 WeakPolarHBondContact CA-O 3.49Å; A65-W88 HydrophobicContact CB-CE3 4.45Å; A65-W88 HydrophobicContact CB-CH2 4.42Å; A65-W88 HydrophobicContact CB-CZ3 3.64Å
66	R	98.7	Very high	98.3	Very high	59 Å²	59	55 Å²	55	22%	0.223	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	141.5	-176.4	-179.6	-171.9	-64.8	163.4	12.5	111.6	V54 T55 E63 Y74 R75 L77	V54-R66 HydrophobicContact CG1-CG 3.82Å; T55-R66 CarbonylContact O-C 3.57Å; T55-R66 VanDerWaalsContact O-CA 3.22Å; T55-R66 WeakPolarHBondContact O-CA 3.32Å; T55-R66 WeakPolarHBondContact O-CG 3.46Å; E63-R66 VanDerWaalsContact CD-NH2 3.26Å; E63-R66 WeakPolarHBondContact OE1-CB 3.48Å; E63-R66 IonicContact OE1-CZ 3.43Å; E63-R66 VanDerWaalsContact OE1-CZ 3.31Å; E63-R66 IonicContact OE1-NE 3.67Å; E63-R66 PolarHBondContact OE1-NE 2.94Å; E63-R66 IonicContact OE1-NH2 2.93Å; E63-R66 PolarHBondContact OE1-NH2 3.36Å; E63-R66 VanDerWaalsContact OE1-NH2 3.11Å; E63-R66 IonicContact OE2-CZ 3.71Å; E63-R66 IonicContact OE2-NE 3.42Å; E63-R66 IonicContact OE2-NH2 3.61Å; E63-R66 PolarHBondContact OE2-NH2 2.97Å; R66-Y74 CarbonylContact O-C 3.58Å; R66-Y74 VanDerWaalsContact O-CA 3.3Å; R66-Y74 WeakPolarHBondContact O-CA 3.5Å; R66-R75 PolarHBondContact N-O 2.96Å; R66-R75 PolarHBondContact O-N 3.2Å; R66-L77 HydrophobicContact CB-CD1 4.11Å; R66-L77 HydrophobicContact CB-CG 4.39Å
67	Y	98.8	Very high	98.3	Very high	6 Å²	6	56.5 Å²	56.5	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140	154.5	171.1	-87.7	0	0	0	109.8	L53 V54 T55 Y74 L93 T96 R97	L53-Y67 HydrophobicContact CD2-CE1 4.12Å; L53-Y67 HydrophobicContact CG-CD1 4.45Å; L53-Y67 HydrophobicContact CG-CE1 4.28Å; V54-Y67 CarbonylContact C-O 3.56Å; V54-Y67 VanDerWaalsContact CA-O 3.32Å; V54-Y67 WeakPolarHBondContact CA-O 3.34Å; T55-Y67 PolarHBondContact N-O 2.93Å; T55-Y67 PolarHBondContact O-N 3.44Å; T55-Y67 WeakPolarHBondContact OG1-CB 3.36Å; Y67-Y74 HydrophobicContact CD2-CD2 4.15Å; Y67-Y74 HydrophobicContact CD2-CE2 4.14Å; Y67-Y74 HydrophobicContact CG-CE2 4.45Å; Y67-L93 HydrophobicContact CD2-CD1 4.31Å; Y67-L93 HydrophobicContact CE2-CD1 4.01Å; Y67-T96 HydrophobicContact CD1-CG2 3.43Å; Y67-T96 VanDerWaalsContact CD1-CG2 3.43Å; Y67-T96 HydrophobicContact CD2-CG2 3.84Å; Y67-T96 HydrophobicContact CE1-CG2 3.72Å; Y67-T96 HydrophobicContact CE2-CG2 4.1Å; Y67-T96 HydrophobicContact CG-CG2 3.5Å; Y67-R97 HydrophobicContact CE2-CG 4.19Å; Y67-R97 WeakPolarHBondContact OH-CA 3.35Å; Y67-R97 VanDerWaalsContact OH-CG 3.31Å; Y67-R97 WeakPolarHBondContact OH-CG 3.45Å
68	D	98.8	Very high	98.2	Very high	12 Å²	12	57 Å²	57	6%	0.064	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	123.7	176.6	-166.2	-32.5	0	0	0	108.7	R52 D70 V71 G72	R52-D68 IonicContact CZ-OD1 3.49Å; R52-D68 IonicContact CZ-OD2 2.78Å; R52-D68 IonicContact NE-OD1 2.75Å; R52-D68 PolarHBondContact NE-OD1 2.98Å; R52-D68 IonicContact NE-OD2 3.05Å; R52-D68 PolarHBondContact NE-OD2 3.37Å; R52-D68 IonicContact NH2-OD1 3.52Å; R52-D68 IonicContact NH2-OD2 3.38Å; R52-D68 PolarHBondContact NH2-OD2 3Å; D68-D70 PolarHBondContact O-N 3.42Å; D68-D70 PolarHBondContact OD1-N 2.97Å; D68-D70 VanDerWaalsContact OD1-N 3.15Å; D68-V71 HydrophobicContact CB-CB 4.18Å; D68-V71 HydrophobicContact CB-CG2 3.99Å; D68-V71 CarbonylContact O-C 3.56Å; D68-V71 PolarHBondContact O-N 3.45Å; D68-G72 PolarHBondContact O-N 3.44Å
69	S	98.5	Very high	98.2	Very high	25 Å²	25	62.5 Å²	62.5	18%	0.175	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.9	-177.8	61.9	0	0	0	0	113.3	R52 L53 V71	R52-S69 WeakPolarHBondContact CA-OG 3.48Å; L53-S69 PolarHBondContact N-OG 3.4Å; L53-S69 PolarHBondContact O-N 3.35Å; L53-S69 PolarHBondContact O-OG 3.1Å; S69-V71 VanDerWaalsContact C-N 3.25Å; S69-V71 PolarHBondContact O-N 2.89Å
70	D	98.3	Very high	98.1	Very high	94 Å²	94	63.8 Å²	63.8	50%	0.503	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-22.9	176.1	-71.8	-3	0	0	0	111.6	R52 D68	R52-D70 WeakPolarHBondContact CD-OD2 3.44Å; R52-D70 IonicContact NE-OD2 3.47Å; D68-D70 PolarHBondContact O-N 3.42Å; D68-D70 PolarHBondContact OD1-N 2.97Å; D68-D70 VanDerWaalsContact OD1-N 3.15Å
71	V	98.4	Very high	98.2	Very high	85 Å²	85	61 Å²	61	52%	0.515	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-35.7	174.9	-179.3	0	0	0	0	111.1	D68 S69 E73 R75	D68-V71 HydrophobicContact CB-CB 4.18Å; D68-V71 HydrophobicContact CB-CG2 3.99Å; D68-V71 CarbonylContact O-C 3.56Å; D68-V71 PolarHBondContact O-N 3.45Å; S69-V71 VanDerWaalsContact C-N 3.25Å; S69-V71 PolarHBondContact O-N 2.89Å; V71-E73 HydrophobicContact CG1-CG 4.24Å; V71-R75 HydrophobicContact CG1-CG 4.34Å
72	G	98.1	Very high	98.3	Very high	15 Å²	15	55.6 Å²	55.6	16%	0.155	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	9.6	175.3	0	0	0	0	0	115.4	D68 L93 R97	D68-G72 PolarHBondContact O-N 3.44Å; G72-L93 WeakPolarHBondContact O-CD1 3.49Å; G72-R97 VanDerWaalsContact O-CZ 3.27Å; G72-R97 PolarHBondContact O-NE 3.44Å; G72-R97 PolarHBondContact O-NH2 3.03Å
73	E	98.4	Very high	98.3	Very high	58 Å²	58	55.3 Å²	55.3	27%	0.271	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	166.5	177.8	67	-178.6	-171	0	0	113.5	V71 R75 L93	V71-E73 HydrophobicContact CG1-CG 4.24Å; E73-R75 IonicContact OE1-CZ 3.31Å; E73-R75 IonicContact OE1-NE 3.15Å; E73-R75 PolarHBondContact OE1-NE 2.78Å; E73-R75 IonicContact OE1-NH1 2.79Å; E73-R75 IonicContact OE1-NH2 2.77Å; E73-R75 PolarHBondContact OE1-NH2 3.21Å; E73-L93 HydrophobicContact CB-CD1 4.01Å; E73-L93 HydrophobicContact CB-CD2 4.46Å
74	Y	98.7	Very high	98.2	Very high	15 Å²	15	55.2 Å²	55.2	6%	0.059	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	131.7	172.9	-71.8	-91.1	0	0	0	110.6	H57 R66 Y67 W88 N89 T96	H57-Y74 AromaticContact NE2-CE1 3.83Å; R66-Y74 CarbonylContact O-C 3.58Å; R66-Y74 VanDerWaalsContact O-CA 3.3Å; R66-Y74 WeakPolarHBondContact O-CA 3.5Å; Y67-Y74 HydrophobicContact CD2-CD2 4.15Å; Y67-Y74 HydrophobicContact CD2-CE2 4.14Å; Y67-Y74 HydrophobicContact CG-CE2 4.45Å; Y74-W88 HydrophobicContact CD1-CB 4.3Å; Y74-W88 HydrophobicContact CD1-CD2 4.39Å; Y74-W88 AromaticContact CD1-CE3 3.56Å; Y74-W88 HydrophobicContact CD1-CE3 3.56Å; Y74-W88 HydrophobicContact CD1-CZ3 4.26Å; Y74-W88 HydrophobicContact CD2-CB 3.83Å; Y74-W88 HydrophobicContact CE1-CD2 4.48Å; Y74-W88 AromaticContact CE1-CE3 3.87Å; Y74-W88 HydrophobicContact CE1-CE3 3.87Å; Y74-W88 HydrophobicContact CE1-CZ3 4.49Å; Y74-W88 HydrophobicContact CE2-CB 4.1Å; Y74-W88 HydrophobicContact CG-CB 3.95Å; Y74-W88 HydrophobicContact CG-CE3 4.19Å; Y74-N89 WeakPolarHBondContact CB-OD1 3.16Å; Y74-N89 PolarHBondContact N-OD1 3.37Å; Y74-N89 PolarHBondContact O-ND2 3.23Å; Y74-T96 HydrophobicContact CE2-CG2 4.17Å; Y74-T96 WeakPolarHBondContact OH-CG2 3.48Å; Y74-T96 PolarHBondContact OH-OG1 3.19Å
75	R	98.6	Very high	98.2	Very high	141 Å²	141	54.5 Å²	54.5	53%	0.532	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.9	174.4	-68.5	-68.2	-174.6	159.9	-1.7	110	A65 R66 V71 E73	A65-R75 VanDerWaalsContact CA-O 3.32Å; A65-R75 WeakPolarHBondContact CA-O 3.49Å; R66-R75 PolarHBondContact N-O 2.96Å; R66-R75 PolarHBondContact O-N 3.2Å; V71-R75 HydrophobicContact CG1-CG 4.34Å; E73-R75 IonicContact OE1-CZ 3.31Å; E73-R75 IonicContact OE1-NE 3.15Å; E73-R75 PolarHBondContact OE1-NE 2.78Å; E73-R75 IonicContact OE1-NH1 2.79Å; E73-R75 IonicContact OE1-NH2 2.77Å; E73-R75 PolarHBondContact OE1-NH2 3.21Å
76	A	98.3	Very high	98.2	Very high	42 Å²	42	59.9 Å²	59.9	35%	0.347	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	127.2	165	0	0	0	0	0	108.6	G81 R82 A85	A76-G81 VanDerWaalsContact CB-C 3.5Å; A76-R82 HydrophobicContact CB-CB 4.36Å; A76-A85 HydrophobicContact CB-CB 4.1Å
77	L	98.1	Very high	98.2	Very high	80 Å²	80	62.7 Å²	62.7	42%	0.419	32%	0.319	S	S	.	.	S	Bend	trans	-92	-26.1	174	-61.6	-178.2	0	0	0	111	E63 Y64 R66	E63-L77 HydrophobicContact CB-CD1 4.13Å; E63-L77 VanDerWaalsContact CD-CD1 3.4Å; E63-L77 HydrophobicContact CG-CD1 3.66Å; E63-L77 WeakPolarHBondContact O-CB 3.48Å; Y64-L77 PolarHBondContact O-N 2.97Å; R66-L77 HydrophobicContact CB-CD1 4.11Å; R66-L77 HydrophobicContact CB-CG 4.39Å
78	T	98	Very high	98.2	Very high	39 Å²	39	64.1 Å²	64.1	24%	0.239	32%	0.324	C	S	.	.	S	Bend	trans	-137.1	167.5	176.4	76.9	0	0	0	0	110.4	E62 Y64 L80 G81	E62-T78 HydrophobicContact CG-CG2 4.03Å; E62-T78 WeakPolarHBondContact OE1-CB 3.39Å; E62-T78 WeakPolarHBondContact OE1-CG2 3.42Å; E62-T78 PolarHBondContact OE1-OG1 3.04Å; Y64-T78 PolarHBondContact O-N 3.32Å; T78-L80 PolarHBondContact O-N 2.97Å; T78-G81 PolarHBondContact O-N 2.91Å
79	E	97.3	Very high	98.2	Very high	133 Å²	133	65.5 Å²	65.5	62%	0.621	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-57.8	-33.2	-177.3	-71.3	-58.3	148	0	0	112.9	G81 R82	E79-G81 PolarHBondContact O-N 3.11Å; E79-R82 PolarHBondContact O-N 3.24Å; E79-R82 IonicContact OE1-CZ 3.99Å; E79-R82 IonicContact OE1-NH2 2.65Å; E79-R82 PolarHBondContact OE1-NH2 2.87Å; E79-R82 IonicContact OE2-CZ 2.67Å; E79-R82 IonicContact OE2-NE 3.1Å; E79-R82 PolarHBondContact OE2-NE 2.86Å; E79-R82 VanDerWaalsContact OE2-NE 3.15Å; E79-R82 IonicContact OE2-NH2 3.68Å; E79-R82 PolarHBondContact OE2-NH2 3.25Å
80	L	96.9	Very high	98.1	Very high	83 Å²	83	71.9 Å²	71.9	44%	0.435	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-56.6	-34.3	176	-179	64.4	0	0	0	112.2	Y59 Y64 T78	Y59-L80 HydrophobicContact CD1-CD2 3.94Å; Y59-L80 HydrophobicContact CG-CD2 4.29Å; Y64-L80 HydrophobicContact CD1-CD2 4.22Å; Y64-L80 HydrophobicContact CG-CD2 4.16Å; Y64-L80 HydrophobicContact CG-CG 4.33Å; T78-L80 PolarHBondContact O-N 2.97Å
81	G	98	Very high	98.1	Very high	0 Å²	0	73 Å²	73	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-86.2	-9.6	-175.5	0	0	0	0	0	116.2	Y64 A76 T78 E79 S84 A85	Y64-G81 VanDerWaalsContact CD2-CA 3.5Å; Y64-G81 WeakPolarHBondContact O-CA 3.48Å; A76-G81 VanDerWaalsContact CB-C 3.5Å; T78-G81 PolarHBondContact O-N 2.91Å; E79-G81 PolarHBondContact O-N 3.11Å; G81-S84 PolarHBondContact O-N 2.87Å; G81-A85 WeakPolarHBondContact O-CB 3.17Å; G81-A85 PolarHBondContact O-N 3.46Å
82	R	98.2	Very high	98.1	Very high	129 Å²	129	73.6 Å²	73.6	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-56.6	-49.2	-175.9	-168.2	-171.5	-62	-155.4	-3.2	112.6	A76 E79 S84 A85 E86	A76-R82 HydrophobicContact CB-CB 4.36Å; E79-R82 PolarHBondContact O-N 3.24Å; E79-R82 IonicContact OE1-CZ 3.99Å; E79-R82 IonicContact OE1-NH2 2.65Å; E79-R82 PolarHBondContact OE1-NH2 2.87Å; E79-R82 IonicContact OE2-CZ 2.67Å; E79-R82 IonicContact OE2-NE 3.1Å; E79-R82 PolarHBondContact OE2-NE 2.86Å; E79-R82 VanDerWaalsContact OE2-NE 3.15Å; E79-R82 IonicContact OE2-NH2 3.68Å; E79-R82 PolarHBondContact OE2-NH2 3.25Å; R82-S84 VanDerWaalsContact C-N 3.33Å; R82-S84 PolarHBondContact O-N 3.06Å; R82-A85 PolarHBondContact O-N 2.79Å; R82-E86 PolarHBondContact O-N 3.24Å
83	P	98	Very high	98.1	Very high	90 Å²	90	73.9 Å²	73.9	58%	0.584	35%	0.35	S	S	*	.	H	α-helix	trans	-63.2	-39.9	179.5	-20	33.5	0	0	0	112.5	Y87	P83-Y87 WeakPolarHBondContact O-CB 3.27Å; P83-Y87 PolarHBondContact O-N 3.05Å; P83-Y87 VanDerWaalsContact O-N 3.15Å
84	S	97.8	Very high	98.1	Very high	32 Å²	32	77 Å²	77	22%	0.224	37%	0.365	C	S	.	.	H	α-helix	trans	-66.4	-47.5	-180	-63.2	0	0	0	0	112	G81 R82 E86 Y87 W88	G81-S84 PolarHBondContact O-N 2.87Å; R82-S84 VanDerWaalsContact C-N 3.33Å; R82-S84 PolarHBondContact O-N 3.06Å; S84-E86 VanDerWaalsContact C-N 3.35Å; S84-E86 PolarHBondContact O-N 3.33Å; S84-Y87 PolarHBondContact O-N 3.05Å; S84-W88 WeakPolarHBondContact O-CB 3.49Å; S84-W88 VanDerWaalsContact O-CD2 3.27Å; S84-W88 PolarHBondContact O-N 3.43Å
85	A	98.4	Very high	98.1	Very high	7 Å²	7	84.6 Å²	84.6	6%	0.058	39%	0.393	C	S	.	.	H	α-helix	trans	-60.7	-43.4	-179.8	0	0	0	0	0	111.8	A76 G81 R82 N89	A76-A85 HydrophobicContact CB-CB 4.1Å; G81-A85 WeakPolarHBondContact O-CB 3.17Å; G81-A85 PolarHBondContact O-N 3.46Å; R82-A85 PolarHBondContact O-N 2.79Å; A85-N89 WeakPolarHBondContact O-CB 3.4Å; A85-N89 PolarHBondContact O-N 3.22Å; A85-N89 PolarHBondContact O-ND2 3.25Å; A85-N89 VanDerWaalsContact O-ND2 3.11Å
86	E	98.1	Very high	98.1	Very high	112 Å²	112	78.1 Å²	78.1	52%	0.523	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-43.6	176.4	-72.8	179.1	-164.2	0	0	112.7	R82 S84 K90	R82-E86 PolarHBondContact O-N 3.24Å; S84-E86 VanDerWaalsContact C-N 3.35Å; S84-E86 PolarHBondContact O-N 3.33Å; E86-K90 WeakPolarHBondContact O-CG 3.29Å
87	Y	98.3	Very high	98.1	Very high	118 Å²	118	80.9 Å²	80.9	46%	0.463	37%	0.371	S	S	.	.	H	α-helix	trans	-68.6	-46.8	178.8	176.4	-104.3	0	0	0	111.9	P83 S84 N89 K90 Q91 Y92	P83-Y87 WeakPolarHBondContact O-CB 3.27Å; P83-Y87 PolarHBondContact O-N 3.05Å; P83-Y87 VanDerWaalsContact O-N 3.15Å; S84-Y87 PolarHBondContact O-N 3.05Å; Y87-N89 VanDerWaalsContact C-N 3.35Å; Y87-N89 PolarHBondContact O-N 3.05Å; Y87-K90 PolarHBondContact O-N 3.47Å; Y87-K90 VanDerWaalsContact O-N 3.08Å; Y87-Q91 HydrophobicContact CD2-CG 4.01Å; Y87-Q91 HydrophobicContact CE1-CB 4.48Å; Y87-Q91 HydrophobicContact CE1-CG 4.16Å; Y87-Q91 HydrophobicContact CE2-CG 3.54Å; Y87-Q91 PolarHBondContact O-N 3.12Å; Y87-Y92 HydrophobicContact CD1-CE2 4.35Å; Y87-Y92 AromaticContact CE1-CE2 3.77Å; Y87-Y92 HydrophobicContact CE1-CE2 3.77Å
88	W	98.6	Very high	98.1	Very high	36 Å²	36	79.2 Å²	79.2	14%	0.136	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-36	-179.1	-62.7	-23	0	0	0	112.7	H57 Y64 A65 Y74 S84 K90 Q91 Y92 L93	H57-W88 HydrophobicContact CB-CH2 3.97Å; H57-W88 HydrophobicContact CB-CZ3 4.23Å; H57-W88 AromaticContact CD2-CH2 3.7Å; H57-W88 AromaticContact CD2-CZ3 3.42Å; H57-W88 VanDerWaalsContact CD2-CZ3 3.42Å; H57-W88 WeakPolarHBondContact CD2-CZ3 3.42Å; H57-W88 AromaticContact CE1-CH2 3.78Å; H57-W88 AromaticContact CG-CH2 3.46Å; H57-W88 VanDerWaalsContact CG-CH2 3.46Å; H57-W88 AromaticContact CG-CZ3 3.66Å; H57-W88 AromaticContact ND1-CH2 3.53Å; H57-W88 AromaticContact NE2-CH2 3.91Å; H57-W88 AromaticContact NE2-CZ3 3.72Å; Y64-W88 AromaticContact CE2-CH2 3.87Å; Y64-W88 HydrophobicContact CE2-CH2 3.87Å; Y64-W88 HydrophobicContact CE2-CZ3 4.41Å; A65-W88 HydrophobicContact CB-CE3 4.45Å; A65-W88 HydrophobicContact CB-CH2 4.42Å; A65-W88 HydrophobicContact CB-CZ3 3.64Å; Y74-W88 HydrophobicContact CD1-CB 4.3Å; Y74-W88 HydrophobicContact CD1-CD2 4.39Å; Y74-W88 AromaticContact CD1-CE3 3.56Å; Y74-W88 HydrophobicContact CD1-CE3 3.56Å; Y74-W88 HydrophobicContact CD1-CZ3 4.26Å; Y74-W88 HydrophobicContact CD2-CB 3.83Å; Y74-W88 HydrophobicContact CE1-CD2 4.48Å; Y74-W88 AromaticContact CE1-CE3 3.87Å; Y74-W88 HydrophobicContact CE1-CE3 3.87Å; Y74-W88 HydrophobicContact CE1-CZ3 4.49Å; Y74-W88 HydrophobicContact CE2-CB 4.1Å; Y74-W88 HydrophobicContact CG-CB 3.95Å; Y74-W88 HydrophobicContact CG-CE3 4.19Å; S84-W88 WeakPolarHBondContact O-CB 3.49Å; S84-W88 VanDerWaalsContact O-CD2 3.27Å; S84-W88 PolarHBondContact O-N 3.43Å; W88-K90 PolarHBondContact O-N 3.05Å; W88-Q91 PolarHBondContact O-N 2.61Å; W88-Y92 HydrophobicContact CB-CD2 4.18Å; W88-Y92 AromaticContact CD1-CD2 3.47Å; W88-Y92 VanDerWaalsContact CD1-CD2 3.47Å; W88-Y92 AromaticContact CD1-CE2 3.61Å; W88-Y92 HydrophobicContact CG-CD2 4.06Å; W88-Y92 PolarHBondContact O-N 3.32Å; W88-L93 PolarHBondContact O-N 2.85Å
89	N	98.7	Very high	98.1	Very high	41 Å²	41	79.4 Å²	79.4	22%	0.219	37%	0.367	C	S	.	.	H	α-helix	trans	-63	-27.4	173.8	-79.3	-33.3	0	0	0	113.1	Y74 A85 Y87 L93	Y74-N89 WeakPolarHBondContact CB-OD1 3.16Å; Y74-N89 PolarHBondContact N-OD1 3.37Å; Y74-N89 PolarHBondContact O-ND2 3.23Å; A85-N89 WeakPolarHBondContact O-CB 3.4Å; A85-N89 PolarHBondContact O-N 3.22Å; A85-N89 PolarHBondContact O-ND2 3.25Å; A85-N89 VanDerWaalsContact O-ND2 3.11Å; Y87-N89 VanDerWaalsContact C-N 3.35Å; Y87-N89 PolarHBondContact O-N 3.05Å; N89-L93 VanDerWaalsContact O-CB 3.31Å; N89-L93 WeakPolarHBondContact O-CB 3.37Å
90	K	97.9	Very high	98.2	Very high	160 Å²	160	74.9 Å²	74.9	70%	0.696	35%	0.347	S	S	*	.	H	α-helix	trans	-83.5	-36.8	176	-67.6	172	-175.8	171.4	0	112.9	E86 Y87 W88	E86-K90 WeakPolarHBondContact O-CG 3.29Å; Y87-K90 PolarHBondContact O-N 3.47Å; Y87-K90 VanDerWaalsContact O-N 3.08Å; W88-K90 PolarHBondContact O-N 3.05Å
91	Q	97.9	Very high	98.2	Very high	118 Å²	118	74.7 Å²	74.7	55%	0.551	35%	0.346	S	S	*	.	H	α-helix	trans	-102.5	-32.3	-168.7	-61.3	-56.1	-41.7	0	0	114.6	Y87 W88	Y87-Q91 HydrophobicContact CD2-CG 4.01Å; Y87-Q91 HydrophobicContact CE1-CB 4.48Å; Y87-Q91 HydrophobicContact CE1-CG 4.16Å; Y87-Q91 HydrophobicContact CE2-CG 3.54Å; Y87-Q91 PolarHBondContact O-N 3.12Å; W88-Q91 PolarHBondContact O-N 2.61Å
92	Y	97.7	Very high	98.2	Very high	97 Å²	97	79 Å²	79	38%	0.38	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-9.2	-166.8	-54.9	-52.8	0	0	0	114.7	Y87 W88 E94 R95 T96	Y87-Y92 HydrophobicContact CD1-CE2 4.35Å; Y87-Y92 AromaticContact CE1-CE2 3.77Å; Y87-Y92 HydrophobicContact CE1-CE2 3.77Å; W88-Y92 HydrophobicContact CB-CD2 4.18Å; W88-Y92 AromaticContact CD1-CD2 3.47Å; W88-Y92 VanDerWaalsContact CD1-CD2 3.47Å; W88-Y92 AromaticContact CD1-CE2 3.61Å; W88-Y92 HydrophobicContact CG-CD2 4.06Å; W88-Y92 PolarHBondContact O-N 3.32Å; Y92-E94 PolarHBondContact O-N 2.93Å; Y92-R95 WeakPolarHBondContact O-CB 3.29Å; Y92-R95 PolarHBondContact O-N 3.2Å; Y92-R95 VanDerWaalsContact O-N 3.09Å; Y92-T96 PolarHBondContact O-N 3.49Å; Y92-T96 PolarHBondContact O-OG1 3.42Å
93	L	98.4	Very high	98.2	Very high	20 Å²	20	75.5 Å²	75.5	11%	0.105	37%	0.366	C	S	.	.	H	α-helix	trans	-52.3	-51.7	-171.8	-176.3	53.8	0	0	0	114.2	Y67 G72 E73 W88 N89 R95 T96 R97	Y67-L93 HydrophobicContact CD2-CD1 4.31Å; Y67-L93 HydrophobicContact CE2-CD1 4.01Å; G72-L93 WeakPolarHBondContact O-CD1 3.49Å; E73-L93 HydrophobicContact CB-CD1 4.01Å; E73-L93 HydrophobicContact CB-CD2 4.46Å; W88-L93 PolarHBondContact O-N 2.85Å; N89-L93 VanDerWaalsContact O-CB 3.31Å; N89-L93 WeakPolarHBondContact O-CB 3.37Å; L93-R95 VanDerWaalsContact C-N 3.31Å; L93-R95 PolarHBondContact O-N 3.08Å; L93-T96 PolarHBondContact O-N 2.9Å; L93-R97 HydrophobicContact CD1-CG 4.43Å; L93-R97 WeakPolarHBondContact O-CG 3.22Å; L93-R97 PolarHBondContact O-N 2.97Å
94	E	98.3	Very high	98.2	Very high	125 Å²	125	71.2 Å²	71.2	58%	0.584	34%	0.338	S	S	*	.	H	α-helix	trans	-65	-36.5	-178.9	-64.8	-50.8	124.3	0	0	112.5	Y92 R97 A98	Y92-E94 PolarHBondContact O-N 2.93Å; E94-R97 PolarHBondContact O-N 2.93Å; E94-R97 IonicContact OE1-CZ 3.16Å; E94-R97 IonicContact OE1-NH1 3.86Å; E94-R97 PolarHBondContact OE1-NH1 3.46Å; E94-A98 PolarHBondContact O-N 3.1Å; E94-A98 VanDerWaalsContact O-N 3.07Å
95	R	98.1	Very high	98.2	Very high	174 Å²	174	73.5 Å²	73.5	66%	0.657	34%	0.341	S	S	*	.	H	α-helix	trans	-64.1	-47.5	174.7	-179.7	180	172.3	169.2	2.6	110.6	Y92 L93 R97 A98 E99	Y92-R95 WeakPolarHBondContact O-CB 3.29Å; Y92-R95 PolarHBondContact O-N 3.2Å; Y92-R95 VanDerWaalsContact O-N 3.09Å; L93-R95 VanDerWaalsContact C-N 3.31Å; L93-R95 PolarHBondContact O-N 3.08Å; R95-R97 VanDerWaalsContact C-N 3.31Å; R95-R97 PolarHBondContact O-N 3.39Å; R95-A98 WeakPolarHBondContact O-CB 3.12Å; R95-A98 PolarHBondContact O-N 2.95Å; R95-A98 VanDerWaalsContact O-N 3.12Å; R95-E99 IonicContact NE-OE1 3.81Å; R95-E99 WeakPolarHBondContact O-CG 3.39Å; R95-E99 PolarHBondContact O-N 2.84Å; R95-E99 VanDerWaalsContact O-N 3.11Å
96	T	98.4	Very high	98.1	Very high	4 Å²	4	78.7 Å²	78.7	3%	0.025	36%	0.364	C	S	.	.	H	α-helix	trans	-65.9	-33.9	179.5	-54.5	0	0	0	0	112.1	T55 Y67 Y74 Y92 L93 A98 E99	T55-T96 HydrophobicContact CG2-CG2 4.42Å; Y67-T96 HydrophobicContact CD1-CG2 3.43Å; Y67-T96 VanDerWaalsContact CD1-CG2 3.43Å; Y67-T96 HydrophobicContact CD2-CG2 3.84Å; Y67-T96 HydrophobicContact CE1-CG2 3.72Å; Y67-T96 HydrophobicContact CE2-CG2 4.1Å; Y67-T96 HydrophobicContact CG-CG2 3.5Å; Y74-T96 HydrophobicContact CE2-CG2 4.17Å; Y74-T96 WeakPolarHBondContact OH-CG2 3.48Å; Y74-T96 PolarHBondContact OH-OG1 3.19Å; Y92-T96 PolarHBondContact O-N 3.49Å; Y92-T96 PolarHBondContact O-OG1 3.42Å; L93-T96 PolarHBondContact O-N 2.9Å; T96-A98 VanDerWaalsContact C-N 3.34Å; T96-A98 PolarHBondContact O-N 3.48Å; T96-E99 WeakPolarHBondContact O-CB 3.34Å; T96-E99 PolarHBondContact O-N 2.82Å
97	R	98.5	Very high	98.1	Very high	100 Å²	100	76.6 Å²	76.6	38%	0.377	36%	0.356	S	S	.	.	H	α-helix	trans	-59.5	-45.3	170.1	-74.8	170.2	176.1	173.2	-4.5	111.6	Y67 G72 L93 E94 R95 E99 L100	Y67-R97 HydrophobicContact CE2-CG 4.19Å; Y67-R97 WeakPolarHBondContact OH-CA 3.35Å; Y67-R97 VanDerWaalsContact OH-CG 3.31Å; Y67-R97 WeakPolarHBondContact OH-CG 3.45Å; G72-R97 VanDerWaalsContact O-CZ 3.27Å; G72-R97 PolarHBondContact O-NE 3.44Å; G72-R97 PolarHBondContact O-NH2 3.03Å; L93-R97 HydrophobicContact CD1-CG 4.43Å; L93-R97 WeakPolarHBondContact O-CG 3.22Å; L93-R97 PolarHBondContact O-N 2.97Å; E94-R97 PolarHBondContact O-N 2.93Å; E94-R97 IonicContact OE1-CZ 3.16Å; E94-R97 IonicContact OE1-NH1 3.86Å; E94-R97 PolarHBondContact OE1-NH1 3.46Å; R95-R97 VanDerWaalsContact C-N 3.31Å; R95-R97 PolarHBondContact O-N 3.39Å; R97-E99 PolarHBondContact O-N 2.85Å; R97-L100 PolarHBondContact O-N 2.88Å
98	A	98.5	Very high	98	Very high	46 Å²	46	73.6 Å²	73.6	38%	0.38	35%	0.345	S	S	.	.	H	α-helix	trans	-67.6	-19.6	177.8	0	0	0	0	0	113.9	E94 R95 T96 L100 D101 T102	E94-A98 PolarHBondContact O-N 3.1Å; E94-A98 VanDerWaalsContact O-N 3.07Å; R95-A98 WeakPolarHBondContact O-CB 3.12Å; R95-A98 PolarHBondContact O-N 2.95Å; R95-A98 VanDerWaalsContact O-N 3.12Å; T96-A98 VanDerWaalsContact C-N 3.34Å; T96-A98 PolarHBondContact O-N 3.48Å; A98-L100 PolarHBondContact O-N 3Å; A98-D101 PolarHBondContact O-N 2.85Å; A98-T102 WeakPolarHBondContact O-CB 3.38Å; A98-T102 WeakPolarHBondContact O-CG2 3.09Å; A98-T102 PolarHBondContact O-N 2.89Å; A98-T102 PolarHBondContact O-OG1 3.37Å
99	E	98.5	Very high	97.8	Very high	43 Å²	43	76.7 Å²	76.7	20%	0.201	36%	0.361	C	S	.	.	H	α-helix	trans	-66.5	-21.7	177.3	-73.4	170.2	179.5	0	0	112.9	L53 R95 T96 R97 D101 T102 V103 C104	L53-E99 HydrophobicContact CD2-CB 3.71Å; R95-E99 IonicContact NE-OE1 3.81Å; R95-E99 WeakPolarHBondContact O-CG 3.39Å; R95-E99 PolarHBondContact O-N 2.84Å; R95-E99 VanDerWaalsContact O-N 3.11Å; T96-E99 WeakPolarHBondContact O-CB 3.34Å; T96-E99 PolarHBondContact O-N 2.82Å; R97-E99 PolarHBondContact O-N 2.85Å; E99-D101 PolarHBondContact O-N 3.38Å; E99-T102 WeakPolarHBondContact CA-OG1 3.49Å; E99-V103 HydrophobicContact CB-CB 4.36Å; E99-V103 HydrophobicContact CB-CG2 3.97Å; E99-V103 HydrophobicContact CG-CG2 3.9Å; E99-V103 WeakPolarHBondContact O-CA 3.5Å; E99-V103 VanDerWaalsContact O-CB 3.24Å; E99-V103 WeakPolarHBondContact O-CB 3.34Å; E99-V103 PolarHBondContact O-N 2.83Å; E99-C104 PolarHBondContact O-N 2.94Å; E99-C104 VanDerWaalsContact O-N 3.09Å
100	L	98.2	Very high	97.6	Very high	37 Å²	37	75.8 Å²	75.8	19%	0.194	36%	0.362	C	S	.	.	I	π-helix	trans	-57.8	-39.8	172.8	-174.7	64.7	0	0	0	111.6	M51 L53 R97 A98 C104 R105	M51-L100 HydrophobicContact CB-CD1 3.85Å; M51-L100 HydrophobicContact CE-CG 4.43Å; L53-L100 HydrophobicContact CB-CB 4.49Å; L53-L100 HydrophobicContact CB-CD1 3.73Å; R97-L100 PolarHBondContact O-N 2.88Å; A98-L100 PolarHBondContact O-N 3Å; L100-C104 VanDerWaalsContact O-CB 3.23Å; L100-C104 WeakPolarHBondContact O-CB 3.07Å; L100-C104 PolarHBondContact O-N 2.83Å; L100-R105 PolarHBondContact O-N 2.76Å; L100-R105 VanDerWaalsContact O-N 3.08Å
101	D	98.3	Very high	97.2	Very high	80 Å²	80	71.4 Å²	71.4	43%	0.428	35%	0.349	S	S	.	.	I	π-helix	trans	-93.5	-48.2	177	-69	-59.2	0	0	0	112	A98 E99 V103 R105 H106	A98-D101 PolarHBondContact O-N 2.85Å; E99-D101 PolarHBondContact O-N 3.38Å; D101-V103 VanDerWaalsContact C-N 3.25Å; D101-V103 PolarHBondContact O-N 2.75Å; D101-R105 WeakPolarHBondContact O-CB 3.32Å; D101-R105 IonicContact OD1-CZ 3.18Å; D101-R105 IonicContact OD1-NE 3.53Å; D101-R105 PolarHBondContact OD1-NE 2.79Å; D101-R105 IonicContact OD1-NH2 2.76Å; D101-R105 PolarHBondContact OD1-NH2 2.83Å; D101-H106 PolarHBondContact O-N 2.94Å
102	T	97.9	Very high	96.9	Very high	89 Å²	89	66.9 Å²	66.9	55%	0.546	33%	0.332	S	S	.	.	I	π-helix	trans	-70.3	-21	-174	59.5	0	0	0	0	113.6	A98 E99 H106	A98-T102 WeakPolarHBondContact O-CB 3.38Å; A98-T102 WeakPolarHBondContact O-CG2 3.09Å; A98-T102 PolarHBondContact O-N 2.89Å; A98-T102 PolarHBondContact O-OG1 3.37Å; E99-T102 WeakPolarHBondContact CA-OG1 3.49Å; T102-H106 VanDerWaalsContact O-CB 3.28Å; T102-H106 WeakPolarHBondContact O-CB 3.35Å
103	V	97.7	Very high	96.5	Very high	57 Å²	57	63.5 Å²	63.5	35%	0.345	32%	0.324	S	S	.	.	I	π-helix	trans	-113	-62.8	175.5	-177.5	0	0	0	0	110.7	E99 D101 N107	E99-V103 HydrophobicContact CB-CB 4.36Å; E99-V103 HydrophobicContact CB-CG2 3.97Å; E99-V103 HydrophobicContact CG-CG2 3.9Å; E99-V103 WeakPolarHBondContact O-CA 3.5Å; E99-V103 VanDerWaalsContact O-CB 3.24Å; E99-V103 WeakPolarHBondContact O-CB 3.34Å; E99-V103 PolarHBondContact O-N 2.83Å; D101-V103 VanDerWaalsContact C-N 3.25Å; D101-V103 PolarHBondContact O-N 2.75Å; V103-N107 WeakPolarHBondContact CG1-ND2 3.02Å; V103-N107 WeakPolarHBondContact O-CB 3.5Å; V103-N107 PolarHBondContact O-N 3.12Å; V103-N107 PolarHBondContact O-ND2 2.97Å
104	C	98	Very high	96.1	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.348	C	S	.	.	I	π-helix	trans	-66	-56.3	-172	-55.5	0	0	0	0	111.9	C42 Y44 M51 E99 L100 H106 N107 Y108	C42-C104 HydrophobicContact CB-CB 3.59Å; C42-C104 WeakPolarHBondContact CB-SG 3.42Å; C42-C104 WeakPolarHBondContact SG-CA 3.02Å; C42-C104 WeakPolarHBondContact SG-CB 3.49Å; C42-C104 CovalentContact SG-SG 2.03Å; C42-C104 PolarHBondContact SG-SG 2.83Å; Y44-C104 HydrophobicContact CE1-CB 4.09Å; Y44-C104 WeakPolarHBondContact OH-CA 3.47Å; Y44-C104 PolarHBondContact OH-O 2.81Å; M51-C104 HydrophobicContact SD-CB 4.47Å; E99-C104 PolarHBondContact O-N 2.94Å; E99-C104 VanDerWaalsContact O-N 3.09Å; L100-C104 VanDerWaalsContact O-CB 3.23Å; L100-C104 WeakPolarHBondContact O-CB 3.07Å; L100-C104 PolarHBondContact O-N 2.83Å; C104-H106 PolarHBondContact O-N 2.77Å; C104-N107 PolarHBondContact O-N 3.05Å; C104-Y108 WeakPolarHBondContact O-CB 3.44Å; C104-Y108 PolarHBondContact O-N 2.87Å
105	R	97.9	Very high	95.8	Very high	79 Å²	79	66.1 Å²	66.1	30%	0.298	35%	0.345	S	S	.	.	I	π-helix	trans	-58.6	-50.6	178.4	-167.7	-177.7	-62.8	-77.8	-2.9	111.6	T48 M51 L100 D101 N107 Y108 E109	T48-R105 HydrophobicContact CG2-CG 4.27Å; T48-R105 PolarHBondContact O-NH1 3.5Å; T48-R105 PolarHBondContact OG1-NH1 3.46Å; M51-R105 HydrophobicContact CE-CB 3.84Å; M51-R105 HydrophobicContact CE-CG 4.3Å; M51-R105 VanDerWaalsContact CE-CZ 3.46Å; M51-R105 HydrophobicContact SD-CB 4.11Å; L100-R105 PolarHBondContact O-N 2.76Å; L100-R105 VanDerWaalsContact O-N 3.08Å; D101-R105 WeakPolarHBondContact O-CB 3.32Å; D101-R105 IonicContact OD1-CZ 3.18Å; D101-R105 IonicContact OD1-NE 3.53Å; D101-R105 PolarHBondContact OD1-NE 2.79Å; D101-R105 IonicContact OD1-NH2 2.76Å; D101-R105 PolarHBondContact OD1-NH2 2.83Å; R105-N107 VanDerWaalsContact C-N 3.34Å; R105-N107 PolarHBondContact O-N 2.9Å; R105-Y108 PolarHBondContact O-N 2.99Å; R105-E109 HydrophobicContact CG-CG 4.22Å; R105-E109 VanDerWaalsContact CG-OE1 3.22Å; R105-E109 WeakPolarHBondContact CG-OE1 3.45Å; R105-E109 IonicContact NH1-OE1 2.72Å; R105-E109 WeakPolarHBondContact O-CB 3.31Å; R105-E109 PolarHBondContact O-N 2.97Å
106	H	96.6	Very high	95.5	Very high	116 Å²	116	59.5 Å²	59.5	54%	0.537	33%	0.325	S	S	.	.	H	α-helix	trans	-54.8	-48.2	-179.5	179.5	73.3	0	0	0	112.3	D101 T102 C104 Y108 G110	D101-H106 PolarHBondContact O-N 2.94Å; T102-H106 VanDerWaalsContact O-CB 3.28Å; T102-H106 WeakPolarHBondContact O-CB 3.35Å; C104-H106 PolarHBondContact O-N 2.77Å; H106-Y108 VanDerWaalsContact C-N 3.35Å; H106-Y108 PolarHBondContact O-N 2.02Å; H106-G110 PolarHBondContact O-N 2.68Å
107	N	96.9	Very high	95.2	Very high	68 Å²	68	63.6 Å²	63.6	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-68.5	-34.3	-179.3	-73.2	-23.3	0	0	0	112.6	V103 C104 R105 A112	V103-N107 WeakPolarHBondContact CG1-ND2 3.02Å; V103-N107 WeakPolarHBondContact O-CB 3.5Å; V103-N107 PolarHBondContact O-N 3.12Å; V103-N107 PolarHBondContact O-ND2 2.97Å; C104-N107 PolarHBondContact O-N 3.05Å; R105-N107 VanDerWaalsContact C-N 3.34Å; R105-N107 PolarHBondContact O-N 2.9Å; N107-A112 VanDerWaalsContact O-CB 3.3Å; N107-A112 WeakPolarHBondContact O-CB 3.33Å; N107-A112 PolarHBondContact O-N 3.47Å
108	Y	96.5	Very high	95	Very high	55 Å²	55	67.1 Å²	67.1	22%	0.216	36%	0.36	C	S	.	.	I	π-helix	trans	-68.5	-51.6	176.6	-169.4	-82.7	0	0	0	111.7	Y44 T48 C104 R105 H106 A113 L117	Y44-Y108 AromaticContact CD1-CD2 3.4Å; Y44-Y108 HydrophobicContact CD1-CD2 3.4Å; Y44-Y108 VanDerWaalsContact CD1-CD2 3.4Å; Y44-Y108 HydrophobicContact CD1-CE2 4.03Å; Y44-Y108 AromaticContact CD1-CG 3.9Å; Y44-Y108 HydrophobicContact CD1-CG 3.9Å; Y44-Y108 AromaticContact CD2-CD2 3.82Å; Y44-Y108 HydrophobicContact CD2-CD2 3.82Å; Y44-Y108 HydrophobicContact CD2-CE2 4.22Å; Y44-Y108 AromaticContact CE1-CD2 3.62Å; Y44-Y108 HydrophobicContact CE1-CD2 3.62Å; Y44-Y108 AromaticContact CE1-CG 3.87Å; Y44-Y108 HydrophobicContact CE1-CG 3.87Å; Y44-Y108 AromaticContact CE2-CD2 4Å; Y44-Y108 HydrophobicContact CE2-CD2 4Å; Y44-Y108 AromaticContact CG-CD2 3.52Å; Y44-Y108 HydrophobicContact CG-CD2 3.52Å; Y44-Y108 AromaticContact CG-CE2 3.81Å; Y44-Y108 HydrophobicContact CG-CE2 3.81Å; Y44-Y108 HydrophobicContact CG-CG 4.45Å; Y44-Y108 AromaticContact CZ-CD2 3.9Å; T48-Y108 HydrophobicContact CG2-CD1 3.38Å; T48-Y108 HydrophobicContact CG2-CE1 4.05Å; T48-Y108 HydrophobicContact CG2-CG 3.76Å; C104-Y108 WeakPolarHBondContact O-CB 3.44Å; C104-Y108 PolarHBondContact O-N 2.87Å; R105-Y108 PolarHBondContact O-N 2.99Å; H106-Y108 VanDerWaalsContact C-N 3.35Å; H106-Y108 PolarHBondContact O-N 2.02Å; Y108-A113 WeakPolarHBondContact O-CB 3.26Å; Y108-A113 PolarHBondContact O-N 2.82Å; Y108-L117 HydrophobicContact CD1-CD1 4.24Å; Y108-L117 HydrophobicContact CD2-CD1 4.37Å; Y108-L117 HydrophobicContact CE1-CD1 3.71Å; Y108-L117 HydrophobicContact CE2-CD1 3.87Å; Y108-L117 HydrophobicContact CE2-CD2 4.41Å; Y108-L117 VanDerWaalsContact CZ-CD1 3.49Å
109	E	95.1	Very high	94.9	Very high	101 Å²	101	68.7 Å²	68.7	47%	0.472	36%	0.356	S	S	.	.	I	π-helix	trans	-78.3	-22.5	-173	-67.7	174.5	-174.8	0	0	113.1	T48 R105 A113	T48-E109 WeakPolarHBondContact CB-OE1 3.34Å; T48-E109 HydrophobicContact CG2-CG 3.84Å; T48-E109 WeakPolarHBondContact CG2-OE1 3.4Å; T48-E109 PolarHBondContact OG1-OE1 3.1Å; R105-E109 HydrophobicContact CG-CG 4.22Å; R105-E109 VanDerWaalsContact CG-OE1 3.22Å; R105-E109 WeakPolarHBondContact CG-OE1 3.45Å; R105-E109 IonicContact NH1-OE1 2.72Å; R105-E109 WeakPolarHBondContact O-CB 3.31Å; R105-E109 PolarHBondContact O-N 2.97Å; E109-A113 WeakPolarHBondContact O-CB 3.48Å
110	G	93.5	Very high	94.9	Very high	23 Å²	23	71.2 Å²	71.2	24%	0.237	37%	0.37	C	S	.	.	I	π-helix	trans	-100.4	-96.1	175	0	0	0	0	0	112.5	H106 A112 A113 L114	H106-G110 PolarHBondContact O-N 2.68Å; G110-A112 PolarHBondContact O-N 3.15Å; G110-A113 PolarHBondContact O-N 2.85Å; G110-L114 WeakPolarHBondContact O-CG 3.47Å; G110-L114 PolarHBondContact O-N 3.3Å
111	P	90.8	Very high	94.9	Very high	67 Å²	67	72.7 Å²	72.7	44%	0.435	38%	0.376	S	S	.	.	I	π-helix	trans	-49.3	-50.2	-174.6	-28.3	31.8	0	0	0	115.1	L114 T115	P111-L114 PolarHBondContact O-N 2.9Å; P111-T115 PolarHBondContact O-N 3.02Å; P111-T115 PolarHBondContact O-OG1 2.78Å
112	A	91.3	Very high	94.9	Very high	24 Å²	24	75.3 Å²	75.3	20%	0.198	39%	0.386	C	S	.	.	I	π-helix	trans	-70.8	-41.1	-175.1	0	0	0	0	0	112.1	N107 G110 L114 T115 S116 L117	N107-A112 VanDerWaalsContact O-CB 3.3Å; N107-A112 WeakPolarHBondContact O-CB 3.33Å; N107-A112 PolarHBondContact O-N 3.47Å; G110-A112 PolarHBondContact O-N 3.15Å; A112-L114 PolarHBondContact O-N 2.85Å; A112-T115 CarbonylContact O-C 3.52Å; A112-T115 PolarHBondContact O-N 2.93Å; A112-S116 PolarHBondContact O-N 2.76Å; A112-S116 VanDerWaalsContact O-N 3.16Å; A112-L117 HydrophobicContact CB-CD1 4.34Å; A112-L117 HydrophobicContact CB-CG 4.27Å; A112-L117 WeakPolarHBondContact O-CB 3.41Å; A112-L117 PolarHBondContact O-N 3.05Å
113	A	89.7	Confident	94.9	Very high	26 Å²	26	71.8 Å²	71.8	22%	0.215	36%	0.364	C	S	.	.	H	α-helix	trans	-59.8	-27.9	176.1	0	0	0	0	0	113.5	Y108 E109 G110 R118	Y108-A113 WeakPolarHBondContact O-CB 3.26Å; Y108-A113 PolarHBondContact O-N 2.82Å; E109-A113 WeakPolarHBondContact O-CB 3.48Å; G110-A113 PolarHBondContact O-N 2.85Å; A113-R118 VanDerWaalsContact O-CD 3.23Å; A113-R118 WeakPolarHBondContact O-CD 3.45Å; A113-R118 VanDerWaalsContact O-CG 3.3Å; A113-R118 WeakPolarHBondContact O-CG 3.42Å; A113-R118 PolarHBondContact O-NE 2.94Å
114	L	89.1	Confident	94.9	Very high	116 Å²	116	73.6 Å²	73.6	61%	0.607	37%	0.372	S	S	*	.	H	α-helix	trans	-90.8	-20.8	178.3	-64.3	176	0	0	0	113.6	G110 P111 A112	G110-L114 WeakPolarHBondContact O-CG 3.47Å; G110-L114 PolarHBondContact O-N 3.3Å; P111-L114 PolarHBondContact O-N 2.9Å; A112-L114 PolarHBondContact O-N 2.85Å
115	T	92.3	Very high	94.9	Very high	84 Å²	84	74.5 Å²	74.5	52%	0.515	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-87.2	-173.2	59.4	0	0	0	0	111.5	P111 A112 L117 R118 R119	P111-T115 PolarHBondContact O-N 3.02Å; P111-T115 PolarHBondContact O-OG1 2.78Å; A112-T115 CarbonylContact O-C 3.52Å; A112-T115 PolarHBondContact O-N 2.93Å; T115-L117 VanDerWaalsContact C-N 3.32Å; T115-L117 PolarHBondContact O-N 2.7Å; T115-R118 PolarHBondContact O-N 2.92Å; T115-R118 VanDerWaalsContact O-N 3.09Å; T115-R119 PolarHBondContact O-N 2.91Å; T115-R119 VanDerWaalsContact O-N 3.1Å
116	S	91.6	Very high	94.9	Very high	34 Å²	34	73 Å²	73	24%	0.238	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-34.9	-168	-59.9	0	0	0	0	113.7	A112 Y149 W179	A112-S116 PolarHBondContact O-N 2.76Å; A112-S116 VanDerWaalsContact O-N 3.16Å; S116-Y149 WeakPolarHBondContact O-CE1 3.43Å; S116-Y149 PolarHBondContact O-OH 3.17Å; S116-W179 WeakPolarHBondContact OG-CH2 3.44Å; S116-W179 WeakPolarHBondContact OG-CZ3 3.31Å
117	L	93.3	Very high	94.9	Very high	91 Å²	91	68.8 Å²	68.8	48%	0.476	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-19.8	-179.6	-64	-180	0	0	0	113.3	Y108 A112 T115	Y108-L117 HydrophobicContact CD1-CD1 4.24Å; Y108-L117 HydrophobicContact CD2-CD1 4.37Å; Y108-L117 HydrophobicContact CE1-CD1 3.71Å; Y108-L117 HydrophobicContact CE2-CD1 3.87Å; Y108-L117 HydrophobicContact CE2-CD2 4.41Å; Y108-L117 VanDerWaalsContact CZ-CD1 3.49Å; A112-L117 HydrophobicContact CB-CD1 4.34Å; A112-L117 HydrophobicContact CB-CG 4.27Å; A112-L117 WeakPolarHBondContact O-CB 3.41Å; A112-L117 PolarHBondContact O-N 3.05Å; T115-L117 VanDerWaalsContact C-N 3.32Å; T115-L117 PolarHBondContact O-N 2.7Å
118	R	94.3	Very high	94.7	Very high	173 Å²	173	68.2 Å²	68.2	65%	0.653	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-8.5	177.5	-69	-179.2	-175.1	-164.2	-1.3	113.2	A113 T115 L120	A113-R118 VanDerWaalsContact O-CD 3.23Å; A113-R118 WeakPolarHBondContact O-CD 3.45Å; A113-R118 VanDerWaalsContact O-CG 3.3Å; A113-R118 WeakPolarHBondContact O-CG 3.42Å; A113-R118 PolarHBondContact O-NE 2.94Å; T115-R118 PolarHBondContact O-N 2.92Å; T115-R118 VanDerWaalsContact O-N 3.09Å; R118-L120 PolarHBondContact O-N 3.26Å
119	R	96.1	Very high	94.3	Very high	79 Å²	79	67.7 Å²	67.7	30%	0.298	37%	0.365	S	S	.	.			trans	-62.6	124.7	178.6	-178.6	173.2	-178.4	65.2	2.8	109.1	T115 E121 Y149 W179	T115-R119 PolarHBondContact O-N 2.91Å; T115-R119 VanDerWaalsContact O-N 3.1Å; R119-E121 HydrophobicContact CG-CG 4.3Å; R119-E121 IonicContact CZ-OE1 2.87Å; R119-E121 IonicContact NE-OE1 3.42Å; R119-E121 IonicContact NH1-OE1 2.66Å; R119-E121 PolarHBondContact NH1-OE1 2.92Å; R119-E121 IonicContact NH2-OE1 3.64Å; R119-E121 PolarHBondContact NH2-OE1 3.01Å; R119-E121 VanDerWaalsContact NH2-OE1 3.1Å; R119-Y149 HydrophobicContact CB-CD1 3.78Å; R119-Y149 HydrophobicContact CB-CE1 3.75Å; R119-Y149 HydrophobicContact CG-CD1 3.58Å; R119-Y149 HydrophobicContact CG-CE1 4Å; R119-Y149 HydrophobicContact CG-CG 4.11Å; R119-Y149 VanDerWaalsContact O-CD1 3.28Å; R119-Y149 WeakPolarHBondContact O-CD1 3.47Å; R119-W179 PolarHBondContact NE-O 3.14Å
120	L	97.7	Very high	93.6	Very high	96 Å²	96	66.8 Å²	66.8	50%	0.503	37%	0.37	S	S	.	.			trans	-135.4	118	175.5	-69.8	174.6	0	0	0	106.9	R118 Y149 P204	R118-L120 PolarHBondContact O-N 3.26Å; L120-Y149 WeakPolarHBondContact CA-O 3.46Å; L120-P204 HydrophobicContact CD2-CB 4.43Å
121	E	97.9	Very high	92.5	Very high	68 Å²	68	75.2 Å²	75.2	32%	0.318	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-121.1	126.9	175.5	-59.6	-64.9	168.2	0	0	108	R119 F148 Y149 H203 S205	R119-E121 HydrophobicContact CG-CG 4.3Å; R119-E121 IonicContact CZ-OE1 2.87Å; R119-E121 IonicContact NE-OE1 3.42Å; R119-E121 IonicContact NH1-OE1 2.66Å; R119-E121 PolarHBondContact NH1-OE1 2.92Å; R119-E121 IonicContact NH2-OE1 3.64Å; R119-E121 PolarHBondContact NH2-OE1 3.01Å; R119-E121 VanDerWaalsContact NH2-OE1 3.1Å; E121-F148 WeakPolarHBondContact O-CA 3.28Å; E121-Y149 PolarHBondContact N-O 2.9Å; E121-Y149 PolarHBondContact O-N 2.73Å; E121-H203 PolarHBondContact O-CE1 2.78Å; E121-H203 VanDerWaalsContact O-CE1 3.26Å; E121-S205 PolarHBondContact O-OG 3.17Å
122	Q	98.1	Very high	91.2	Very high	136 Å²	136	77.9 Å²	77.9	64%	0.636	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-76.3	138.1	-176.3	-65	-178.6	21.7	0	0	111.1	S205 L206	Q122-S205 VanDerWaalsContact CA-OG 3.3Å; Q122-S205 WeakPolarHBondContact CA-OG 3.05Å; Q122-S205 WeakPolarHBondContact CG-OG 3.23Å; Q122-L206 HydrophobicContact CB-CD2 4.21Å; Q122-L206 HydrophobicContact CG-CD2 4.07Å
123	P	98.4	Very high	89.8	Confident	14 Å²	14	79 Å²	79	9%	0.091	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-66.2	137.4	177.2	24.6	-32.2	0	0	0	112.1	V125 V145 T146 F148 V201 H203 L206	P123-V125 HydrophobicContact CB-CG2 4.28Å; P123-V145 HydrophobicContact CB-CG1 3.54Å; P123-T146 WeakPolarHBondContact CA-O 3.38Å; P123-F148 HydrophobicContact CB-CB 3.87Å; P123-F148 HydrophobicContact CB-CD1 4.27Å; P123-F148 HydrophobicContact CB-CG 4.36Å; P123-V201 HydrophobicContact CB-CG1 4.4Å; P123-V201 HydrophobicContact CG-CG1 3.95Å; P123-H203 HydrophobicContact CG-CB 4.23Å; P123-L206 HydrophobicContact CG-CD1 3.91Å; P123-L206 HydrophobicContact CG-CD2 4.49Å; P123-L206 HydrophobicContact CG-CG 4.38Å
124	N	98.1	Very high	88.7	Confident	96 Å²	96	79.5 Å²	79.5	51%	0.513	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	129	159.4	-171.1	-32.1	0	0	0	108.7	V145 T146	N124-V145 CarbonylContact O-C 3.6Å; N124-V145 VanDerWaalsContact O-CA 3.31Å; N124-V145 WeakPolarHBondContact O-CA 3.4Å; N124-T146 PolarHBondContact N-O 3.26Å; N124-T146 PolarHBondContact O-N 3.17Å
125	V	98.4	Very high	87.6	Confident	19 Å²	19	76.2 Å²	76.2	12%	0.115	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.2	-175	-173.2	0	0	0	0	109.3	P123 S144 V145 V201 V210 V212	P123-V125 HydrophobicContact CB-CG2 4.28Å; V125-S144 WeakPolarHBondContact CA-O 3.36Å; V125-V145 HydrophobicContact CG1-CG2 4.41Å; V125-V145 HydrophobicContact CG2-CG1 4.35Å; V125-V145 HydrophobicContact CG2-CG2 4.48Å; V125-V201 HydrophobicContact CG1-CG2 3.94Å; V125-V201 HydrophobicContact CG2-CB 4.13Å; V125-V201 HydrophobicContact CG2-CG1 4.4Å; V125-V201 HydrophobicContact CG2-CG2 3.73Å; V125-V210 HydrophobicContact CB-CG1 4.16Å; V125-V210 HydrophobicContact CG2-CB 4.46Å; V125-V210 HydrophobicContact CG2-CG1 3.87Å; V125-V212 HydrophobicContact CB-CG2 3.8Å; V125-V212 HydrophobicContact CG1-CB 4.15Å; V125-V212 HydrophobicContact CG1-CG2 3.58Å
126	A	97.4	Very high	86.5	Confident	46 Å²	46	77.8 Å²	77.8	38%	0.38	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.4	176.6	0	0	0	0	0	110.8	C143 S144	A126-C143 WeakPolarHBondContact O-CA 3.08Å; A126-S144 PolarHBondContact N-O 3.31Å; A126-S144 PolarHBondContact O-N 3.11Å
127	I	96.3	Very high	85.8	Confident	29 Å²	29	82 Å²	82	15%	0.149	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.7	171.1	-60.4	174.4	0	0	0	108.9	L141 V142 W157 C199 V212 W214	I127-L141 HydrophobicContact CG2-CD2 4.02Å; I127-V142 WeakPolarHBondContact CA-O 3.1Å; I127-W157 HydrophobicContact CD1-CH2 3.82Å; I127-W157 HydrophobicContact CD1-CZ3 3.84Å; I127-W157 HydrophobicContact CG1-CH2 3.95Å; I127-W157 HydrophobicContact CG1-CZ3 4.47Å; I127-W157 HydrophobicContact CG2-CH2 3.86Å; I127-C199 HydrophobicContact CD1-CB 3.76Å; I127-C199 HydrophobicContact CG1-CB 3.99Å; I127-V212 HydrophobicContact CD1-CB 4.11Å; I127-V212 HydrophobicContact CD1-CG1 3.93Å; I127-V212 WeakPolarHBondContact CD1-O 3.29Å; I127-V212 HydrophobicContact CG1-CB 4.33Å; I127-V212 HydrophobicContact CG1-CG1 3.97Å; I127-W214 HydrophobicContact CB-CB 4.22Å; I127-W214 HydrophobicContact CD1-CB 4.06Å; I127-W214 HydrophobicContact CG2-CB 3.65Å; I127-W214 HydrophobicContact CG2-CG 3.95Å
128	S	92.3	Very high	85.1	Confident	55 Å²	55	85.6 Å²	85.6	39%	0.385	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154	174.6	59.8	0	0	0	0	111.1	V142	S128-V142 PolarHBondContact N-O 3.27Å; S128-V142 PolarHBondContact O-N 3Å
129	L	89.2	Confident	84.7	Confident	45 Å²	45	78.2 Å²	78.2	24%	0.236	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139	166.4	-79	159.6	0	0	0	109.1	R131 E133 N139 L141 W214	L129-R131 VanDerWaalsContact CB-O 3.27Å; L129-R131 WeakPolarHBondContact CB-O 3.21Å; L129-R131 PolarHBondContact O-N 3.08Å; L129-E133 HydrophobicContact CD1-CB 3.76Å; L129-E133 HydrophobicContact CD1-CG 4.17Å; L129-N139 HydrophobicContact CD2-CB 4.18Å; L129-L141 HydrophobicContact CD2-CD2 3.68Å; L129-L141 HydrophobicContact CD2-CG 4.45Å; L129-L141 HydrophobicContact CG-CD2 3.94Å; L129-W214 HydrophobicContact CD1-CZ2 3.65Å; L129-W214 HydrophobicContact CD2-CH2 4.46Å; L129-W214 HydrophobicContact CD2-CZ2 4.11Å; L129-W214 HydrophobicContact CG-CZ2 3.99Å
130	S	79.4	Confident	84.5	Confident	81 Å²	81	76.7 Å²	76.7	57%	0.566	40%	0.403	S	S	*	.	S	Bend	trans	-67.7	-24.5	173.3	-179.1	0	0	0	0	113	L140	S130-L140 PolarHBondContact N-O 2.93Å
131	R	71.4	Confident	84.4	Confident	201 Å²	201	72.1 Å²	72.1	76%	0.758	38%	0.379	S	S	*	.	S	Bend	trans	-143.9	166.6	-178.8	-159.3	-179.2	-72.1	-168.9	-0.3	111.1	L129 E133	L129-R131 VanDerWaalsContact CB-O 3.27Å; L129-R131 WeakPolarHBondContact CB-O 3.21Å; L129-R131 PolarHBondContact O-N 3.08Å; R131-E133 PolarHBondContact O-N 2.83Å
132	T	62.8	Low	84.3	Confident	122 Å²	122	69.8 Å²	69.8	75%	0.748	37%	0.37	S	S	*	.			trans	-48.9	133.8	173	-46.8	0	0	0	0	111.9	A134	T132-A134 PolarHBondContact O-N 3.2Å
133	E	62.9	Low	84.3	Confident	49 Å²	49	63.3 Å²	63.3	23%	0.229	34%	0.34	C	S	.	.			trans	-62.3	116.2	-175.5	-172.4	172.6	-162.5	0	0	111.7	L129 R131 W214 A216 Q217	L129-E133 HydrophobicContact CD1-CB 3.76Å; L129-E133 HydrophobicContact CD1-CG 4.17Å; R131-E133 PolarHBondContact O-N 2.83Å; E133-W214 HydrophobicContact CG-CZ2 4.5Å; E133-W214 WeakPolarHBondContact OE1-CZ2 3.43Å; E133-A216 WeakPolarHBondContact OE1-CA 3.21Å; E133-Q217 PolarHBondContact OE1-N 2.84Å
134	A	65	Low	84.3	Confident	36 Å²	36	64.1 Å²	64.1	30%	0.298	35%	0.345	S	S	.	.			trans	-125.5	111.2	172.2	0	0	0	0	0	109.7	T132 H137 N139	T132-A134 PolarHBondContact O-N 3.2Å; A134-H137 HydrophobicContact CB-CB 3.99Å; A134-H137 PolarHBondContact O-N 2.9Å; A134-N139 PolarHBondContact O-ND2 3.28Å
135	L	66.5	Low	84.3	Confident	46 Å²	46	59.5 Å²	59.5	24%	0.241	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	146.6	176.9	-68.4	174.4	0	0	0	110.9	H137 P191 A216	L135-H137 PolarHBondContact O-N 2.83Å; L135-H137 VanDerWaalsContact O-N 3.12Å; L135-H137 PolarHBondContact O-ND1 3.2Å; L135-P191 HydrophobicContact CD2-CB 4.3Å; L135-A216 HydrophobicContact CD2-CB 4.07Å
136	N	69.3	Low	84.3	Confident	118 Å²	118	60 Å²	60	63%	0.631	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	17.9	-178.6	-53.3	-44.5	0	0	0	115.2	P191	N136-P191 PolarHBondContact N-O 3.23Å
137	H	76.3	Confident	84.3	Confident	122 Å²	122	61.3 Å²	61.3	57%	0.565	33%	0.325	S	S	*	.	S	Bend	trans	-116.3	158.4	171.7	-69.5	74.8	0	0	0	110.8	A134 L135 N139 P191	A134-H137 HydrophobicContact CB-CB 3.99Å; A134-H137 PolarHBondContact O-N 2.9Å; L135-H137 PolarHBondContact O-N 2.83Å; L135-H137 VanDerWaalsContact O-N 3.12Å; L135-H137 PolarHBondContact O-ND1 3.2Å; H137-N139 PolarHBondContact O-N 2.62Å; H137-N139 PolarHBondContact O-ND2 3.25Å; H137-P191 VanDerWaalsContact O-CD 3.28Å; H137-P191 WeakPolarHBondContact O-CD 3.48Å
138	H	80.4	Confident	84.4	Confident	167 Å²	167	60 Å²	60	77%	0.773	32%	0.318	S	S	*	.			trans	-61.7	122.5	171.9	-73.2	-74.3	0	0	0	110.3
139	N	85.8	Confident	84.7	Confident	17 Å²	17	59.1 Å²	59.1	9%	0.091	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	163.4	175.2	-70.9	-77.7	0	0	0	109.3	L129 A134 H137 M189 P191	L129-N139 HydrophobicContact CD2-CB 4.18Å; A134-N139 PolarHBondContact O-ND2 3.28Å; H137-N139 PolarHBondContact O-N 2.62Å; H137-N139 PolarHBondContact O-ND2 3.25Å; N139-M189 HydrophobicContact CB-SD 3.83Å; N139-M189 PolarHBondContact N-O 2.72Å; N139-M189 PolarHBondContact O-N 2.97Å; N139-P191 VanDerWaalsContact ND2-CD 3.32Å; N139-P191 WeakPolarHBondContact ND2-CD 3.22Å; N139-P191 WeakPolarHBondContact ND2-CG 3.4Å
140	L	91.1	Very high	85.1	Confident	47 Å²	47	58.7 Å²	58.7	25%	0.246	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.5	176.5	-172.2	76.1	0	0	0	108.2	S130 V142 M186 L187 E188	S130-L140 PolarHBondContact N-O 2.93Å; L140-V142 HydrophobicContact CD2-CG2 4.49Å; L140-M186 HydrophobicContact CD1-CB 4.04Å; L140-M186 HydrophobicContact CD2-CB 4.44Å; L140-M186 HydrophobicContact CD2-SD 4.35Å; L140-M186 HydrophobicContact CG-CB 4.31Å; L140-L187 WeakPolarHBondContact CA-O 3.32Å; L140-E188 HydrophobicContact CD1-CB 4.46Å; L140-E188 HydrophobicContact CD1-CG 3.65Å
141	L	94.6	Very high	86	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	139.9	168.6	-73.2	174	0	0	0	109.3	I127 L129 W157 M186 L187 M189 Y197 W214	I127-L141 HydrophobicContact CG2-CD2 4.02Å; L129-L141 HydrophobicContact CD2-CD2 3.68Å; L129-L141 HydrophobicContact CD2-CG 4.45Å; L129-L141 HydrophobicContact CG-CD2 3.94Å; L141-W157 HydrophobicContact CB-CH2 3.91Å; L141-W157 HydrophobicContact CB-CZ2 4.04Å; L141-W157 HydrophobicContact CD1-CH2 4.34Å; L141-W157 HydrophobicContact CD1-CZ3 4.39Å; L141-M186 CarbonylContact O-C 3.57Å; L141-M186 VanDerWaalsContact O-CA 3.22Å; L141-M186 WeakPolarHBondContact O-CA 3.42Å; L141-L187 HydrophobicContact CB-CB 4.5Å; L141-L187 PolarHBondContact N-O 3.48Å; L141-L187 PolarHBondContact O-N 2.87Å; L141-M189 HydrophobicContact CD1-CE 3.99Å; L141-M189 HydrophobicContact CD1-CG 4.24Å; L141-M189 HydrophobicContact CG-CG 4.24Å; L141-M189 HydrophobicContact CG-SD 4.46Å; L141-Y197 HydrophobicContact CD1-CD1 3.99Å; L141-Y197 HydrophobicContact CD1-CD2 4.04Å; L141-Y197 HydrophobicContact CD1-CG 3.63Å; L141-W214 HydrophobicContact CD1-CD2 4.25Å; L141-W214 HydrophobicContact CD1-CE3 3.74Å; L141-W214 HydrophobicContact CD1-CZ3 4.23Å; L141-W214 HydrophobicContact CD2-CD2 3.64Å; L141-W214 HydrophobicContact CD2-CE3 3.89Å; L141-W214 HydrophobicContact CD2-CG 3.99Å; L141-W214 HydrophobicContact CD2-CZ2 4.42Å; L141-W214 HydrophobicContact CD2-CZ3 4.35Å; L141-W214 HydrophobicContact CG-CE3 4.42Å
142	V	96.6	Very high	87.2	Confident	20 Å²	20	54.4 Å²	54.4	12%	0.121	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	117.1	177.9	-172	0	0	0	0	108.1	I127 S128 L140 L184 M186	I127-V142 WeakPolarHBondContact CA-O 3.1Å; S128-V142 PolarHBondContact N-O 3.27Å; S128-V142 PolarHBondContact O-N 3Å; L140-V142 HydrophobicContact CD2-CG2 4.49Å; V142-L184 HydrophobicContact CG1-CB 4.39Å; V142-L184 HydrophobicContact CG1-CD2 4.4Å; V142-M186 HydrophobicContact CG1-CG 4.16Å; V142-M186 HydrophobicContact CG2-CG 4.13Å
143	C	97.9	Very high	88.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	106.5	166.5	-176.3	0	0	0	0	108	A126 W157 V185 C199	A126-C143 WeakPolarHBondContact O-CA 3.08Å; C143-W157 HydrophobicContact CB-CH2 4.07Å; C143-W157 HydrophobicContact CB-CZ2 3.46Å; C143-W157 VanDerWaalsContact CB-CZ2 3.46Å; C143-V185 PolarHBondContact N-O 2.62Å; C143-V185 PolarHBondContact O-N 3.46Å; C143-C199 HydrophobicContact CB-CB 3.67Å; C143-C199 WeakPolarHBondContact CB-SG 3.38Å; C143-C199 WeakPolarHBondContact SG-CB 3.49Å; C143-C199 CovalentContact SG-SG 2.02Å; C143-C199 PolarHBondContact SG-SG 2.94Å
144	S	98.1	Very high	90.6	Very high	30 Å²	30	53.3 Å²	53.3	21%	0.21	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	116.5	174.9	-58.6	0	0	0	0	108.7	V125 A126 L184	V125-S144 WeakPolarHBondContact CA-O 3.36Å; A126-S144 PolarHBondContact N-O 3.31Å; A126-S144 PolarHBondContact O-N 3.11Å; S144-L184 WeakPolarHBondContact OG-CD2 3.5Å
145	V	98.6	Very high	92.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	109.7	176.8	-173	0	0	0	0	108	P123 N124 V125 F148 I153 V155 Q182 I183 V201	P123-V145 HydrophobicContact CB-CG1 3.54Å; N124-V145 CarbonylContact O-C 3.6Å; N124-V145 VanDerWaalsContact O-CA 3.31Å; N124-V145 WeakPolarHBondContact O-CA 3.4Å; V125-V145 HydrophobicContact CG1-CG2 4.41Å; V125-V145 HydrophobicContact CG2-CG1 4.35Å; V125-V145 HydrophobicContact CG2-CG2 4.48Å; V145-F148 HydrophobicContact CB-CE1 4.48Å; V145-F148 HydrophobicContact CG1-CD1 3.95Å; V145-F148 HydrophobicContact CG1-CE1 3.98Å; V145-F148 WeakPolarHBondContact O-CE1 3.3Å; V145-I153 HydrophobicContact CG1-CD1 3.55Å; V145-V155 HydrophobicContact CG2-CG1 4.23Å; V145-V155 HydrophobicContact CG2-CG2 4.04Å; V145-Q182 CarbonylContact O-C 3.58Å; V145-Q182 VanDerWaalsContact O-CA 3.26Å; V145-Q182 WeakPolarHBondContact O-CA 3.42Å; V145-I183 HydrophobicContact CB-CG2 3.89Å; V145-I183 HydrophobicContact CG1-CG2 4.47Å; V145-I183 PolarHBondContact N-O 3.31Å; V145-I183 PolarHBondContact O-N 2.89Å; V145-V201 HydrophobicContact CG1-CG1 4.06Å; V145-V201 HydrophobicContact CG1-CG2 4.44Å; V145-V201 HydrophobicContact CG2-CG2 3.74Å
146	T	98.4	Very high	93.7	Very high	28 Å²	28	53.1 Å²	53.1	17%	0.172	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	165.3	-169.3	67.1	0	0	0	0	112.5	P123 N124 F148 Q182	P123-T146 WeakPolarHBondContact CA-O 3.38Å; N124-T146 PolarHBondContact N-O 3.26Å; N124-T146 PolarHBondContact O-N 3.17Å; T146-F148 VanDerWaalsContact C-N 3.28Å; T146-F148 PolarHBondContact O-N 3.32Å; T146-Q182 HydrophobicContact CG2-CB 4.08Å
147	D	98.1	Very high	95.1	Very high	75 Å²	75	47.6 Å²	47.6	40%	0.401	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	62.7	26.3	165.7	-45.6	-47.2	0	0	0	115.4	F181	D147-F181 PolarHBondContact N-O 2.88Å; D147-F181 VanDerWaalsContact N-O 3.08Å
148	F	98.5	Very high	96.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	156.7	-178	65.2	-89.3	0	0	0	113.8	E121 P123 V145 T146 P150 I153 L173 T180 F181 I183 H203	E121-F148 WeakPolarHBondContact O-CA 3.28Å; P123-F148 HydrophobicContact CB-CB 3.87Å; P123-F148 HydrophobicContact CB-CD1 4.27Å; P123-F148 HydrophobicContact CB-CG 4.36Å; V145-F148 HydrophobicContact CB-CE1 4.48Å; V145-F148 HydrophobicContact CG1-CD1 3.95Å; V145-F148 HydrophobicContact CG1-CE1 3.98Å; V145-F148 WeakPolarHBondContact O-CE1 3.3Å; T146-F148 VanDerWaalsContact C-N 3.28Å; T146-F148 PolarHBondContact O-N 3.32Å; F148-P150 WeakPolarHBondContact CD2-O 3.46Å; F148-I153 HydrophobicContact CD1-CD1 3.89Å; F148-I153 HydrophobicContact CD2-CB 4.43Å; F148-I153 HydrophobicContact CD2-CD1 3.87Å; F148-I153 HydrophobicContact CE1-CD1 3.67Å; F148-I153 HydrophobicContact CE2-CB 3.81Å; F148-I153 HydrophobicContact CE2-CD1 3.66Å; F148-I153 HydrophobicContact CE2-CG1 4.33Å; F148-I153 HydrophobicContact CE2-CG2 3.8Å; F148-I153 HydrophobicContact CG-CD1 3.99Å; F148-I153 HydrophobicContact CZ-CB 4.18Å; F148-I153 HydrophobicContact CZ-CD1 3.55Å; F148-I153 HydrophobicContact CZ-CG1 4.47Å; F148-I153 HydrophobicContact CZ-CG2 3.79Å; F148-L173 HydrophobicContact CE2-CD1 3.96Å; F148-L173 HydrophobicContact CZ-CD1 3.58Å; F148-T180 CarbonylContact O-C 3.6Å; F148-T180 WeakPolarHBondContact O-CA 3.33Å; F148-F181 VanDerWaalsContact CD1-O 3.28Å; F148-F181 WeakPolarHBondContact CD1-O 3.39Å; F148-F181 HydrophobicContact CD2-CB 4.16Å; F148-F181 HydrophobicContact CE1-CB 4.28Å; F148-F181 WeakPolarHBondContact CE1-O 3.11Å; F148-F181 HydrophobicContact CE2-CB 3.72Å; F148-F181 HydrophobicContact CZ-CB 3.79Å; F148-F181 PolarHBondContact N-O 2.94Å; F148-F181 PolarHBondContact O-N 2.96Å; F148-I183 HydrophobicContact CE1-CG2 4.01Å; F148-I183 HydrophobicContact CZ-CG2 4Å; F148-H203 AromaticContact CD2-CD2 3.86Å; F148-H203 AromaticContact CD2-NE2 3.7Å
149	Y	98.3	Very high	96.9	Very high	38 Å²	38	38.7 Å²	38.7	15%	0.149	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-155.9	137	172.3	-173.9	-79.9	0	0	0	109.5	S116 R119 L120 E121 W179 F181 H203	S116-Y149 WeakPolarHBondContact O-CE1 3.43Å; S116-Y149 PolarHBondContact O-OH 3.17Å; R119-Y149 HydrophobicContact CB-CD1 3.78Å; R119-Y149 HydrophobicContact CB-CE1 3.75Å; R119-Y149 HydrophobicContact CG-CD1 3.58Å; R119-Y149 HydrophobicContact CG-CE1 4Å; R119-Y149 HydrophobicContact CG-CG 4.11Å; R119-Y149 VanDerWaalsContact O-CD1 3.28Å; R119-Y149 WeakPolarHBondContact O-CD1 3.47Å; L120-Y149 WeakPolarHBondContact CA-O 3.46Å; E121-Y149 PolarHBondContact N-O 2.9Å; E121-Y149 PolarHBondContact O-N 2.73Å; Y149-W179 WeakPolarHBondContact CD2-O 3.49Å; Y149-W179 HydrophobicContact CE2-CE3 4.13Å; Y149-F181 HydrophobicContact CD2-CD2 4.07Å; Y149-F181 AromaticContact CD2-CE2 3.58Å; Y149-F181 HydrophobicContact CD2-CE2 3.58Å; Y149-F181 AromaticContact CE2-CE2 3.89Å; Y149-F181 HydrophobicContact CE2-CE2 3.89Å; Y149-H203 VanDerWaalsContact C-CE1 3.47Å; Y149-H203 PolarHBondContact O-CE1 2.91Å
150	P	97.9	Very high	97.3	Very high	36 Å²	36	42.2 Å²	42.2	23%	0.234	22%	0.215	C	C	.	.	S	Bend	cis	-80	-176.2	9.6	34.2	-39.1	0	0	0	114.4	F148 Q152 H203 P204	F148-P150 WeakPolarHBondContact CD2-O 3.46Å; P150-Q152 VanDerWaalsContact C-N 3.25Å; P150-Q152 PolarHBondContact O-N 2.77Å; P150-H203 PolarHBondContact O-NE2 3.37Å; P150-H203 VanDerWaalsContact O-NE2 3.11Å; P150-P204 HydrophobicContact CG-CG 4.4Å
151	A	97.6	Very high	97.4	Very high	42 Å²	42	43 Å²	43	35%	0.347	23%	0.234	S	C	.	.	S	Bend	trans	-62.7	-25.9	-178.3	0	0	0	0	0	114.9	I153 L173 F181	A151-I153 PolarHBondContact O-N 2.87Å; A151-L173 HydrophobicContact CB-CD2 3.42Å; A151-L173 VanDerWaalsContact CB-CD2 3.42Å; A151-F181 HydrophobicContact CB-CD2 4.17Å; A151-F181 HydrophobicContact CB-CE1 4.22Å; A151-F181 HydrophobicContact CB-CE2 3.78Å; A151-F181 HydrophobicContact CB-CZ 3.81Å
152	Q	96.9	Very high	97.5	Very high	149 Å²	149	50.3 Å²	50.3	70%	0.696	27%	0.268	S	S	*	.			trans	-70.2	116	-176.9	-179.9	-176.9	8.6	0	0	110.1	P150 H203 P204	P150-Q152 VanDerWaalsContact C-N 3.25Å; P150-Q152 PolarHBondContact O-N 2.77Å; Q152-H203 PolarHBondContact O-CD2 3.24Å; Q152-P204 WeakPolarHBondContact O-CD 3.41Å
153	I	98.3	Very high	97.6	Very high	37 Å²	37	53.9 Å²	53.9	19%	0.19	28%	0.284	C	S	.	.			trans	-145.8	151.4	179.8	-166.4	164	0	0	0	110.7	V145 F148 A151 V155 I183 V201 H203	V145-I153 HydrophobicContact CG1-CD1 3.55Å; F148-I153 HydrophobicContact CD1-CD1 3.89Å; F148-I153 HydrophobicContact CD2-CB 4.43Å; F148-I153 HydrophobicContact CD2-CD1 3.87Å; F148-I153 HydrophobicContact CE1-CD1 3.67Å; F148-I153 HydrophobicContact CE2-CB 3.81Å; F148-I153 HydrophobicContact CE2-CD1 3.66Å; F148-I153 HydrophobicContact CE2-CG1 4.33Å; F148-I153 HydrophobicContact CE2-CG2 3.8Å; F148-I153 HydrophobicContact CG-CD1 3.99Å; F148-I153 HydrophobicContact CZ-CB 4.18Å; F148-I153 HydrophobicContact CZ-CD1 3.55Å; F148-I153 HydrophobicContact CZ-CG1 4.47Å; F148-I153 HydrophobicContact CZ-CG2 3.79Å; A151-I153 PolarHBondContact O-N 2.87Å; I153-V155 HydrophobicContact CD1-CG2 4.13Å; I153-V155 HydrophobicContact CG1-CG2 4.02Å; I153-I183 HydrophobicContact CD1-CG2 4.43Å; I153-I183 HydrophobicContact CG2-CG2 4.28Å; I153-V201 HydrophobicContact CD1-CG1 3.94Å; I153-V201 HydrophobicContact CG1-CG1 4.21Å; I153-H203 HydrophobicContact CG1-CB 4.36Å
154	K	98.3	Very high	97.5	Very high	111 Å²	111	56.2 Å²	56.2	48%	0.483	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	119	171.9	-178	179.1	-177.6	-179.4	0	109.7	D202	K154-D202 HydrophobicContact CB-CB 4.27Å; K154-D202 PolarHBondContact N-O 3.24Å; K154-D202 PolarHBondContact O-N 3.04Å
155	V	98.4	Very high	97.4	Very high	28 Å²	28	59.7 Å²	59.7	17%	0.17	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.5	-179	-176.2	0	0	0	0	108.8	V145 I153 I183 V185 H200 V201	V145-V155 HydrophobicContact CG2-CG1 4.23Å; V145-V155 HydrophobicContact CG2-CG2 4.04Å; I153-V155 HydrophobicContact CD1-CG2 4.13Å; I153-V155 HydrophobicContact CG1-CG2 4.02Å; V155-I183 HydrophobicContact CG2-CG2 4.09Å; V155-V185 HydrophobicContact CB-CG2 3.75Å; V155-V185 HydrophobicContact CG1-CB 3.91Å; V155-V185 HydrophobicContact CG1-CG1 4.4Å; V155-V185 HydrophobicContact CG1-CG2 3.55Å; V155-V185 HydrophobicContact CG2-CG2 4.37Å; V155-H200 CarbonylContact C-O 3.56Å; V155-H200 WeakPolarHBondContact CA-O 3.47Å; V155-V201 HydrophobicContact CG1-CG2 4.21Å; V155-V201 HydrophobicContact CG2-CG1 4.42Å; V155-V201 HydrophobicContact CG2-CG2 4.28Å
156	R	98.3	Very high	97.2	Very high	51 Å²	51	64.8 Å²	64.8	19%	0.192	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	148.3	-177.3	-68.7	-179.9	-73.8	166.3	0.5	111.1	F158 E163 H200	R156-F158 HydrophobicContact CB-CD2 4.39Å; R156-F158 HydrophobicContact CB-CE2 3.78Å; R156-E163 VanDerWaalsContact CD-CD 3.49Å; R156-E163 WeakPolarHBondContact CD-OE1 3.28Å; R156-E163 WeakPolarHBondContact CD-OE2 3.29Å; R156-E163 IonicContact NH1-OE2 3.05Å; R156-E163 PolarHBondContact NH1-OE2 2.79Å; R156-H200 HydrophobicContact CB-CB 4.45Å; R156-H200 PolarHBondContact N-O 3.49Å; R156-H200 PolarHBondContact NH2-CE1 3.45Å; R156-H200 PolarHBondContact NH2-NE2 3.1Å; R156-H200 PolarHBondContact O-N 3.16Å
157	W	98.3	Very high	97	Very high	1 Å²	1	64.9 Å²	64.9	0%	0.004	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	144.4	170.4	-82.9	108.1	0	0	0	110.7	I127 L141 C143 E163 E164 V168 V185 L187 T198 C199	I127-W157 HydrophobicContact CD1-CH2 3.82Å; I127-W157 HydrophobicContact CD1-CZ3 3.84Å; I127-W157 HydrophobicContact CG1-CH2 3.95Å; I127-W157 HydrophobicContact CG1-CZ3 4.47Å; I127-W157 HydrophobicContact CG2-CH2 3.86Å; L141-W157 HydrophobicContact CB-CH2 3.91Å; L141-W157 HydrophobicContact CB-CZ2 4.04Å; L141-W157 HydrophobicContact CD1-CH2 4.34Å; L141-W157 HydrophobicContact CD1-CZ3 4.39Å; C143-W157 HydrophobicContact CB-CH2 4.07Å; C143-W157 HydrophobicContact CB-CZ2 3.46Å; C143-W157 VanDerWaalsContact CB-CZ2 3.46Å; W157-E163 WeakPolarHBondContact O-CA 3.49Å; W157-E164 HydrophobicContact CB-CB 4.3Å; W157-E164 PolarHBondContact O-N 3.15Å; W157-V168 HydrophobicContact CB-CG2 4.21Å; W157-V168 HydrophobicContact CG-CG2 4.45Å; W157-V185 PolarHBondContact NE1-O 2.87Å; W157-L187 HydrophobicContact CB-CD2 4.25Å; W157-L187 HydrophobicContact CD2-CB 4.1Å; W157-L187 HydrophobicContact CD2-CD2 4.04Å; W157-L187 HydrophobicContact CE3-CD2 4.16Å; W157-L187 HydrophobicContact CG-CB 4.06Å; W157-L187 HydrophobicContact CG-CD2 4.1Å; W157-L187 HydrophobicContact CZ2-CB 4.45Å; W157-T198 CarbonylContact C-O 3.54Å; W157-C199 HydrophobicContact CE3-CB 4.36Å; W157-C199 HydrophobicContact CH2-CB 4.21Å; W157-C199 HydrophobicContact CZ3-CB 4.11Å
158	F	97.9	Very high	96.9	Very high	32 Å²	32	63.5 Å²	63.5	14%	0.14	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.4	170.3	-70.3	-105.3	0	0	0	109.1	R156 Q162 E163 Y197 T198 H200	R156-F158 HydrophobicContact CB-CD2 4.39Å; R156-F158 HydrophobicContact CB-CE2 3.78Å; F158-Q162 CarbonylContact C-O 3.5Å; F158-Q162 WeakPolarHBondContact CA-O 3.47Å; F158-E163 HydrophobicContact CD1-CB 4.07Å; F158-E163 HydrophobicContact CE1-CB 3.68Å; F158-E163 HydrophobicContact CE1-CG 4.31Å; F158-E163 HydrophobicContact CE2-CG 4.38Å; F158-E163 HydrophobicContact CZ-CB 3.96Å; F158-E163 HydrophobicContact CZ-CG 4.07Å; F158-Y197 CarbonylContact O-C 3.6Å; F158-Y197 WeakPolarHBondContact O-CA 3.3Å; F158-T198 PolarHBondContact N-O 2.71Å; F158-T198 PolarHBondContact O-N 2.83Å; F158-H200 HydrophobicContact CD2-CB 3.83Å; F158-H200 HydrophobicContact CE2-CB 3.68Å; F158-H200 AromaticContact CE2-CG 3.92Å; F158-H200 AromaticContact CE2-ND1 3.39Å; F158-H200 WeakPolarHBondContact CE2-ND1 3.43Å; F158-H200 AromaticContact CZ-ND1 3.82Å
159	R	95.9	Very high	96.8	Very high	70 Å²	70	67.2 Å²	67.2	26%	0.264	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.5	169.5	-178.6	-176	179.3	177.8	4.7	108.6	G161 Q162 D195 V196 Y197	R159-G161 PolarHBondContact O-N 3.06Å; R159-G161 VanDerWaalsContact O-N 3.08Å; R159-Q162 PolarHBondContact N-O 2.77Å; R159-Q162 PolarHBondContact O-N 2.95Å; R159-D195 IonicContact CZ-OD1 3.11Å; R159-D195 IonicContact CZ-OD2 3.64Å; R159-D195 IonicContact NE-OD1 2.7Å; R159-D195 PolarHBondContact NE-OD1 2.79Å; R159-D195 IonicContact NE-OD2 3.2Å; R159-D195 IonicContact NH2-OD1 3.82Å; R159-D195 PolarHBondContact NH2-OD1 2.86Å; R159-D195 IonicContact NH2-OD2 3.19Å; R159-D195 PolarHBondContact NH2-OD2 2.65Å; R159-V196 WeakPolarHBondContact CA-O 3.3Å; R159-Y197 HydrophobicContact CB-CD1 4.19Å; R159-Y197 HydrophobicContact CB-CE1 4.05Å; R159-Y197 HydrophobicContact CG-CD1 4.19Å; R159-Y197 HydrophobicContact CG-CE1 3.71Å; R159-Y197 PolarHBondContact NE-OH 2.91Å
160	N	94.9	Very high	96.7	Very high	91 Å²	91	68.9 Å²	68.9	49%	0.487	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	36.2	179.6	-56.4	-34	0	0	0	112.9	D195 V196	N160-D195 PolarHBondContact ND2-OD1 2.91Å; N160-D195 WeakPolarHBondContact OD1-CA 3.49Å; N160-V196 PolarHBondContact N-O 2.93Å; N160-V196 PolarHBondContact OD1-N 3.42Å
161	G	93.9	Very high	96.6	Very high	63 Å²	63	69.1 Å²	69.1	65%	0.649	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	-3.8	-179.7	0	0	0	0	0	116.1	R159	R159-G161 PolarHBondContact O-N 3.06Å; R159-G161 VanDerWaalsContact O-N 3.08Å
162	Q	96.6	Very high	96.5	Very high	155 Å²	155	75.5 Å²	75.5	72%	0.724	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.5	175.1	-65.5	-170.9	-23.8	0	0	111	F158 R159 E164	F158-Q162 CarbonylContact C-O 3.5Å; F158-Q162 WeakPolarHBondContact CA-O 3.47Å; R159-Q162 PolarHBondContact N-O 2.77Å; R159-Q162 PolarHBondContact O-N 2.95Å; Q162-E164 PolarHBondContact O-N 2.99Å
163	E	97.6	Very high	96.5	Very high	95 Å²	95	71.7 Å²	71.7	44%	0.444	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	125.9	179.8	-170.3	166	159.2	0	0	110.1	R156 W157 F158 T165	R156-E163 VanDerWaalsContact CD-CD 3.49Å; R156-E163 WeakPolarHBondContact CD-OE1 3.28Å; R156-E163 WeakPolarHBondContact CD-OE2 3.29Å; R156-E163 IonicContact NH1-OE2 3.05Å; R156-E163 PolarHBondContact NH1-OE2 2.79Å; W157-E163 WeakPolarHBondContact O-CA 3.49Å; F158-E163 HydrophobicContact CD1-CB 4.07Å; F158-E163 HydrophobicContact CE1-CB 3.68Å; F158-E163 HydrophobicContact CE1-CG 4.31Å; F158-E163 HydrophobicContact CE2-CG 4.38Å; F158-E163 HydrophobicContact CZ-CB 3.96Å; F158-E163 HydrophobicContact CZ-CG 4.07Å; E163-T165 HydrophobicContact CG-CG2 4.5Å
164	E	96.4	Very high	96.5	Very high	49 Å²	49	73 Å²	73	23%	0.229	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.2	179.3	-171.3	61.7	-102.7	0	0	109	W157 Q162 T166 V168 L187	W157-E164 HydrophobicContact CB-CB 4.3Å; W157-E164 PolarHBondContact O-N 3.15Å; Q162-E164 PolarHBondContact O-N 2.99Å; E164-T166 WeakPolarHBondContact OE1-CB 3.38Å; E164-T166 PolarHBondContact OE1-N 3.35Å; E164-V168 WeakPolarHBondContact O-CG2 3.49Å; E164-L187 HydrophobicContact CG-CD1 3.68Å; E164-L187 HydrophobicContact CG-CD2 4.43Å
165	T	96.6	Very high	96.5	Very high	102 Å²	102	76.5 Å²	76.5	63%	0.626	41%	0.41	S	S	*	.			trans	-125.1	-19.2	178.5	56.1	0	0	0	0	111.7	E163 V168	E163-T165 HydrophobicContact CG-CG2 4.5Å; T165-V168 PolarHBondContact O-N 3.2Å
166	T	95.2	Very high	96.4	Very high	108 Å²	108	77.8 Å²	77.8	66%	0.663	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	129.8	178.8	-51.6	0	0	0	0	108.9	E164 V168	E164-T166 WeakPolarHBondContact OE1-CB 3.38Å; E164-T166 PolarHBondContact OE1-N 3.35Å; T166-V168 PolarHBondContact O-N 2.85Å
167	G	92.2	Very high	96.3	Very high	30 Å²	30	78.6 Å²	78.6	31%	0.309	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	11.3	-178.5	0	0	0	0	0	114.3	L187 E188	G167-L187 WeakPolarHBondContact O-CA 3.4Å; G167-E188 PolarHBondContact O-N 2.72Å
168	V	96.9	Very high	96.2	Very high	46 Å²	46	82.9 Å²	82.9	28%	0.279	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.1	173.4	178.8	0	0	0	0	110.3	W157 E164 T165 T166 V185 M186 L187	W157-V168 HydrophobicContact CB-CG2 4.21Å; W157-V168 HydrophobicContact CG-CG2 4.45Å; E164-V168 WeakPolarHBondContact O-CG2 3.49Å; T165-V168 PolarHBondContact O-N 3.2Å; T166-V168 PolarHBondContact O-N 2.85Å; V168-V185 HydrophobicContact CG1-CG1 3.66Å; V168-M186 CarbonylContact C-O 3.48Å; V168-M186 VanDerWaalsContact CA-O 3.29Å; V168-M186 WeakPolarHBondContact CA-O 3.46Å; V168-L187 HydrophobicContact CG2-CD1 3.69Å
169	V	96.2	Very high	96.1	Very high	78 Å²	78	88.5 Å²	88.5	47%	0.473	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	125.5	176.8	-177.8	0	0	0	0	109.3	M186	V169-M186 HydrophobicContact CB-CE 4.24Å; V169-M186 HydrophobicContact CG1-CE 4.01Å; V169-M186 PolarHBondContact N-O 3.11Å; V169-M186 WeakPolarHBondContact O-CE 3.47Å; V169-M186 PolarHBondContact O-N 2.7Å
170	S	96.2	Very high	96.2	Very high	73 Å²	73	85.7 Å²	85.7	51%	0.51	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.4	175.8	61.8	0	0	0	0	111.7	L184	S170-L184 WeakPolarHBondContact CA-O 3.08Å
171	T	96	Very high	96.4	Very high	40 Å²	40	81.8 Å²	81.8	25%	0.245	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-67.8	164.3	165.2	63.1	0	0	0	0	110.9	L184 M186	T171-L184 HydrophobicContact CG2-CB 3.84Å; T171-L184 HydrophobicContact CG2-CD1 4.41Å; T171-L184 HydrophobicContact CG2-CG 4.41Å; T171-L184 PolarHBondContact N-O 3.28Å; T171-L184 PolarHBondContact OG1-N 2.83Å; T171-L184 VanDerWaalsContact OG1-N 3.12Å; T171-M186 HydrophobicContact CG2-CE 4.43Å
172	Q	96.3	Very high	96.6	Very high	176 Å²	176	81.5 Å²	81.5	82%	0.822	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-63.9	160.7	158.2	-66.1	-175.1	-3.9	0	0	109.7	I174	Q172-I174 PolarHBondContact O-N 2.81Å
173	L	96.9	Very high	96.7	Very high	69 Å²	69	75.1 Å²	75.1	36%	0.361	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-64.4	123.4	175.6	-168.7	72.3	0	0	0	109.9	F148 A151 F181 I183	F148-L173 HydrophobicContact CE2-CD1 3.96Å; F148-L173 HydrophobicContact CZ-CD1 3.58Å; A151-L173 HydrophobicContact CB-CD2 3.42Å; A151-L173 VanDerWaalsContact CB-CD2 3.42Å; L173-F181 HydrophobicContact CD1-CB 3.9Å; L173-F181 HydrophobicContact CD1-CD1 4.4Å; L173-F181 HydrophobicContact CD1-CG 4.37Å; L173-F181 HydrophobicContact CD2-CB 4.38Å; L173-F181 HydrophobicContact CD2-CD1 3.49Å; L173-F181 VanDerWaalsContact CD2-CD1 3.49Å; L173-F181 HydrophobicContact CD2-CE1 3.85Å; L173-F181 HydrophobicContact CD2-CG 3.95Å; L173-F181 HydrophobicContact CG-CB 4.14Å; L173-F181 HydrophobicContact CG-CD1 3.72Å; L173-F181 HydrophobicContact CG-CE1 4.48Å; L173-F181 HydrophobicContact CG-CG 4.17Å; L173-I183 HydrophobicContact CD1-CB 4.43Å
174	I	97.6	Very high	96.7	Very high	64 Å²	64	72.9 Å²	72.9	33%	0.328	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	128.7	-178.9	-59.4	163.6	0	0	0	108.3	Q172 F181 Q182	Q172-I174 PolarHBondContact O-N 2.81Å; I174-F181 VanDerWaalsContact O-CA 3.29Å; I174-F181 WeakPolarHBondContact O-CA 3.32Å; I174-Q182 HydrophobicContact CB-CG 3.53Å; I174-Q182 HydrophobicContact CD1-CG 4.02Å; I174-Q182 HydrophobicContact CG1-CG 4.33Å; I174-Q182 HydrophobicContact CG2-CG 3.76Å; I174-Q182 PolarHBondContact N-O 3.46Å; I174-Q182 PolarHBondContact O-N 3.1Å
175	R	97.7	Very high	96.7	Very high	185 Å²	185	70.8 Å²	70.8	70%	0.698	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.3	175.4	-176.1	-174.8	-62.7	-85.2	0.3	109.3	F181	R175-F181 HydrophobicContact CB-CD1 4.33Å; R175-F181 HydrophobicContact CB-CE1 4.19Å; R175-F181 HydrophobicContact CG-CE1 4.2Å
176	N	96.9	Very high	96.7	Very high	56 Å²	56	68.2 Å²	68.2	30%	0.299	37%	0.369	S	S	.	.			trans	-76.6	-23.8	-175.7	-67.8	-20.9	0	0	0	113.4	D178 T180 Q182	N176-D178 WeakPolarHBondContact CB-OD1 3.5Å; N176-T180 PolarHBondContact N-O 3.27Å; N176-T180 PolarHBondContact ND2-OG1 3.2Å; N176-Q182 WeakPolarHBondContact OD1-CG 3.34Å; N176-Q182 PolarHBondContact OD1-NE2 2.67Å
177	G	95.9	Very high	96.8	Very high	68 Å²	68	63.1 Å²	63.1	70%	0.701	34%	0.338	S	S	*	.	S	Bend	trans	93.1	-0.8	-178	0	0	0	0	0	114.3
178	D	96.4	Very high	96.9	Very high	90 Å²	90	67.7 Å²	67.7	48%	0.481	35%	0.351	S	S	.	.	S	Bend	trans	-115.7	23.3	-179.4	66.2	-7.1	0	0	0	112.8	N176 T180	N176-D178 WeakPolarHBondContact CB-OD1 3.5Å; D178-T180 VanDerWaalsContact C-N 3.3Å; D178-T180 PolarHBondContact O-N 3.39Å; D178-T180 WeakPolarHBondContact OD1-CB 3.26Å; D178-T180 PolarHBondContact OD1-N 3.29Å; D178-T180 PolarHBondContact OD1-OG1 3.22Å
179	W	96	Very high	96.6	Very high	150 Å²	150	66.2 Å²	66.2	57%	0.568	34%	0.341	S	S	*	.	S	Bend	trans	66.9	24	-173.6	-60	75.3	0	0	0	115.2	S116 R119 Y149	S116-W179 WeakPolarHBondContact OG-CH2 3.44Å; S116-W179 WeakPolarHBondContact OG-CZ3 3.31Å; R119-W179 PolarHBondContact NE-O 3.14Å; Y149-W179 WeakPolarHBondContact CD2-O 3.49Å; Y149-W179 HydrophobicContact CE2-CE3 4.13Å
180	T	98.1	Very high	96.3	Very high	12 Å²	12	64.8 Å²	64.8	7%	0.074	33%	0.332	C	S	.	.			trans	-121.7	163.4	167.1	69.9	0	0	0	0	111.9	F148 N176 D178	F148-T180 CarbonylContact O-C 3.6Å; F148-T180 WeakPolarHBondContact O-CA 3.33Å; N176-T180 PolarHBondContact N-O 3.27Å; N176-T180 PolarHBondContact ND2-OG1 3.2Å; D178-T180 VanDerWaalsContact C-N 3.3Å; D178-T180 PolarHBondContact O-N 3.39Å; D178-T180 WeakPolarHBondContact OD1-CB 3.26Å; D178-T180 PolarHBondContact OD1-N 3.29Å; D178-T180 PolarHBondContact OD1-OG1 3.22Å
181	F	98.5	Very high	95.8	Very high	9 Å²	9	61.3 Å²	61.3	4%	0.039	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	160.2	175.7	-61.7	-83.1	0	0	0	110.9	D147 F148 Y149 A151 L173 I174 R175	D147-F181 PolarHBondContact N-O 2.88Å; D147-F181 VanDerWaalsContact N-O 3.08Å; F148-F181 VanDerWaalsContact CD1-O 3.28Å; F148-F181 WeakPolarHBondContact CD1-O 3.39Å; F148-F181 HydrophobicContact CD2-CB 4.16Å; F148-F181 HydrophobicContact CE1-CB 4.28Å; F148-F181 WeakPolarHBondContact CE1-O 3.11Å; F148-F181 HydrophobicContact CE2-CB 3.72Å; F148-F181 HydrophobicContact CZ-CB 3.79Å; F148-F181 PolarHBondContact N-O 2.94Å; F148-F181 PolarHBondContact O-N 2.96Å; Y149-F181 HydrophobicContact CD2-CD2 4.07Å; Y149-F181 AromaticContact CD2-CE2 3.58Å; Y149-F181 HydrophobicContact CD2-CE2 3.58Å; Y149-F181 AromaticContact CE2-CE2 3.89Å; Y149-F181 HydrophobicContact CE2-CE2 3.89Å; A151-F181 HydrophobicContact CB-CD2 4.17Å; A151-F181 HydrophobicContact CB-CE1 4.22Å; A151-F181 HydrophobicContact CB-CE2 3.78Å; A151-F181 HydrophobicContact CB-CZ 3.81Å; L173-F181 HydrophobicContact CD1-CB 3.9Å; L173-F181 HydrophobicContact CD1-CD1 4.4Å; L173-F181 HydrophobicContact CD1-CG 4.37Å; L173-F181 HydrophobicContact CD2-CB 4.38Å; L173-F181 HydrophobicContact CD2-CD1 3.49Å; L173-F181 VanDerWaalsContact CD2-CD1 3.49Å; L173-F181 HydrophobicContact CD2-CE1 3.85Å; L173-F181 HydrophobicContact CD2-CG 3.95Å; L173-F181 HydrophobicContact CG-CB 4.14Å; L173-F181 HydrophobicContact CG-CD1 3.72Å; L173-F181 HydrophobicContact CG-CE1 4.48Å; L173-F181 HydrophobicContact CG-CG 4.17Å; I174-F181 VanDerWaalsContact O-CA 3.29Å; I174-F181 WeakPolarHBondContact O-CA 3.32Å; R175-F181 HydrophobicContact CB-CD1 4.33Å; R175-F181 HydrophobicContact CB-CE1 4.19Å; R175-F181 HydrophobicContact CG-CE1 4.2Å
182	Q	98.2	Very high	95.3	Very high	56 Å²	56	64.6 Å²	64.6	26%	0.262	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152.4	168.9	63.8	-178.2	-41.2	0	0	110.8	V145 T146 I174 N176	V145-Q182 CarbonylContact O-C 3.58Å; V145-Q182 VanDerWaalsContact O-CA 3.26Å; V145-Q182 WeakPolarHBondContact O-CA 3.42Å; T146-Q182 HydrophobicContact CG2-CB 4.08Å; I174-Q182 HydrophobicContact CB-CG 3.53Å; I174-Q182 HydrophobicContact CD1-CG 4.02Å; I174-Q182 HydrophobicContact CG1-CG 4.33Å; I174-Q182 HydrophobicContact CG2-CG 3.76Å; I174-Q182 PolarHBondContact N-O 3.46Å; I174-Q182 PolarHBondContact O-N 3.1Å; N176-Q182 WeakPolarHBondContact OD1-CG 3.34Å; N176-Q182 PolarHBondContact OD1-NE2 2.67Å
183	I	98.3	Very high	94.8	Very high	21 Å²	21	65.4 Å²	65.4	11%	0.108	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138.4	174.2	-171.5	170.5	0	0	0	109.4	V145 F148 I153 V155 L173 V185	V145-I183 HydrophobicContact CB-CG2 3.89Å; V145-I183 HydrophobicContact CG1-CG2 4.47Å; V145-I183 PolarHBondContact N-O 3.31Å; V145-I183 PolarHBondContact O-N 2.89Å; F148-I183 HydrophobicContact CE1-CG2 4.01Å; F148-I183 HydrophobicContact CZ-CG2 4Å; I153-I183 HydrophobicContact CD1-CG2 4.43Å; I153-I183 HydrophobicContact CG2-CG2 4.28Å; V155-I183 HydrophobicContact CG2-CG2 4.09Å; L173-I183 HydrophobicContact CD1-CB 4.43Å; I183-V185 HydrophobicContact CD1-CG2 4.45Å; I183-V185 HydrophobicContact CG1-CG2 4.29Å
184	L	97.8	Very high	94.2	Very high	49 Å²	49	64.9 Å²	64.9	26%	0.257	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.7	174.8	-56.1	177.8	0	0	0	108.6	V142 S144 S170 T171	V142-L184 HydrophobicContact CG1-CB 4.39Å; V142-L184 HydrophobicContact CG1-CD2 4.4Å; S144-L184 WeakPolarHBondContact OG-CD2 3.5Å; S170-L184 WeakPolarHBondContact CA-O 3.08Å; T171-L184 HydrophobicContact CG2-CB 3.84Å; T171-L184 HydrophobicContact CG2-CD1 4.41Å; T171-L184 HydrophobicContact CG2-CG 4.41Å; T171-L184 PolarHBondContact N-O 3.28Å; T171-L184 PolarHBondContact OG1-N 2.83Å; T171-L184 VanDerWaalsContact OG1-N 3.12Å
185	V	97.9	Very high	93.9	Very high	5 Å²	5	62.2 Å²	62.2	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	109.6	176.3	-172.5	0	0	0	0	109.2	C143 V155 W157 V168 I183	C143-V185 PolarHBondContact N-O 2.62Å; C143-V185 PolarHBondContact O-N 3.46Å; V155-V185 HydrophobicContact CB-CG2 3.75Å; V155-V185 HydrophobicContact CG1-CB 3.91Å; V155-V185 HydrophobicContact CG1-CG1 4.4Å; V155-V185 HydrophobicContact CG1-CG2 3.55Å; V155-V185 HydrophobicContact CG2-CG2 4.37Å; W157-V185 PolarHBondContact NE1-O 2.87Å; V168-V185 HydrophobicContact CG1-CG1 3.66Å; I183-V185 HydrophobicContact CD1-CG2 4.45Å; I183-V185 HydrophobicContact CG1-CG2 4.29Å
186	M	96.6	Very high	93.8	Very high	47 Å²	47	54.4 Å²	54.4	23%	0.232	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	145.1	-173.7	-58.3	165.9	-76	0	0	110.2	L140 L141 V142 V168 V169 T171	L140-M186 HydrophobicContact CD1-CB 4.04Å; L140-M186 HydrophobicContact CD2-CB 4.44Å; L140-M186 HydrophobicContact CD2-SD 4.35Å; L140-M186 HydrophobicContact CG-CB 4.31Å; L141-M186 CarbonylContact O-C 3.57Å; L141-M186 VanDerWaalsContact O-CA 3.22Å; L141-M186 WeakPolarHBondContact O-CA 3.42Å; V142-M186 HydrophobicContact CG1-CG 4.16Å; V142-M186 HydrophobicContact CG2-CG 4.13Å; V168-M186 CarbonylContact C-O 3.48Å; V168-M186 VanDerWaalsContact CA-O 3.29Å; V168-M186 WeakPolarHBondContact CA-O 3.46Å; V169-M186 HydrophobicContact CB-CE 4.24Å; V169-M186 HydrophobicContact CG1-CE 4.01Å; V169-M186 PolarHBondContact N-O 3.11Å; V169-M186 WeakPolarHBondContact O-CE 3.47Å; V169-M186 PolarHBondContact O-N 2.7Å; T171-M186 HydrophobicContact CG2-CE 4.43Å
187	L	96.5	Very high	93.7	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	116.6	176.7	171.4	65.1	0	0	0	109.8	L140 L141 W157 E164 G167 V168 M189 Y197	L140-L187 WeakPolarHBondContact CA-O 3.32Å; L141-L187 HydrophobicContact CB-CB 4.5Å; L141-L187 PolarHBondContact N-O 3.48Å; L141-L187 PolarHBondContact O-N 2.87Å; W157-L187 HydrophobicContact CB-CD2 4.25Å; W157-L187 HydrophobicContact CD2-CB 4.1Å; W157-L187 HydrophobicContact CD2-CD2 4.04Å; W157-L187 HydrophobicContact CE3-CD2 4.16Å; W157-L187 HydrophobicContact CG-CB 4.06Å; W157-L187 HydrophobicContact CG-CD2 4.1Å; W157-L187 HydrophobicContact CZ2-CB 4.45Å; E164-L187 HydrophobicContact CG-CD1 3.68Å; E164-L187 HydrophobicContact CG-CD2 4.43Å; G167-L187 WeakPolarHBondContact O-CA 3.4Å; V168-L187 HydrophobicContact CG2-CD1 3.69Å; L187-M189 HydrophobicContact CG-CB 4.33Å; L187-Y197 HydrophobicContact CD2-CD1 3.71Å; L187-Y197 HydrophobicContact CD2-CE1 4.06Å
188	E	94.2	Very high	93.8	Very high	126 Å²	126	49.5 Å²	49.5	59%	0.589	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	126.4	168.5	-69.4	-176.3	-171.7	0	0	110.3	L140 G167	L140-E188 HydrophobicContact CD1-CB 4.46Å; L140-E188 HydrophobicContact CD1-CG 3.65Å; G167-E188 PolarHBondContact O-N 2.72Å
189	M	89.8	Confident	93.9	Very high	14 Å²	14	45.2 Å²	45.2	7%	0.069	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	168.5	-172.2	58.5	84.5	77.3	0	0	112.7	N139 L141 L187 P191 Y197 W214	N139-M189 HydrophobicContact CB-SD 3.83Å; N139-M189 PolarHBondContact N-O 2.72Å; N139-M189 PolarHBondContact O-N 2.97Å; L141-M189 HydrophobicContact CD1-CE 3.99Å; L141-M189 HydrophobicContact CD1-CG 4.24Å; L141-M189 HydrophobicContact CG-CG 4.24Å; L141-M189 HydrophobicContact CG-SD 4.46Å; L187-M189 HydrophobicContact CG-CB 4.33Å; M189-P191 HydrophobicContact CE-CB 3.52Å; M189-P191 HydrophobicContact CE-CG 4.05Å; M189-P191 HydrophobicContact SD-CB 4.03Å; M189-P191 WeakPolarHBondContact SD-CD 3.5Å; M189-P191 HydrophobicContact SD-CG 3.87Å; M189-Y197 HydrophobicContact CB-CE1 4.21Å; M189-Y197 HydrophobicContact CE-CD1 4.24Å; M189-Y197 HydrophobicContact CE-CD2 3.71Å; M189-Y197 HydrophobicContact CE-CE1 3.66Å; M189-Y197 HydrophobicContact CE-CE2 3.03Å; M189-Y197 HydrophobicContact CE-CG 4.27Å; M189-Y197 VanDerWaalsContact CE-OH 3.28Å; M189-Y197 WeakPolarHBondContact CE-OH 3.42Å; M189-W214 HydrophobicContact CE-CZ3 3.96Å
190	T	89.6	Confident	94	Very high	48 Å²	48	39.6 Å²	39.6	29%	0.294	20%	0.202	S	C	.	.			trans	-130.2	99.6	172.6	-58.4	0	0	0	0	107.4	Q192	T190-Q192 PolarHBondContact O-N 3.15Å
191	P	86.8	Confident	94.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-68	126.6	-169	19.9	-19.6	0	0	0	110.2	L135 N136 H137 N139 M189 W214 A216	L135-P191 HydrophobicContact CD2-CB 4.3Å; N136-P191 PolarHBondContact N-O 3.23Å; H137-P191 VanDerWaalsContact O-CD 3.28Å; H137-P191 WeakPolarHBondContact O-CD 3.48Å; N139-P191 VanDerWaalsContact ND2-CD 3.32Å; N139-P191 WeakPolarHBondContact ND2-CD 3.22Å; N139-P191 WeakPolarHBondContact ND2-CG 3.4Å; M189-P191 HydrophobicContact CE-CB 3.52Å; M189-P191 HydrophobicContact CE-CG 4.05Å; M189-P191 HydrophobicContact SD-CB 4.03Å; M189-P191 WeakPolarHBondContact SD-CD 3.5Å; M189-P191 HydrophobicContact SD-CG 3.87Å; P191-W214 HydrophobicContact CB-CH2 4.25Å; P191-W214 HydrophobicContact CB-CZ3 4.36Å; P191-A216 HydrophobicContact CB-CB 3.79Å
192	Q	85.6	Confident	94.1	Very high	110 Å²	110	42 Å²	42	51%	0.514	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-100.1	155	166.9	-61.5	-169.8	0.7	0	0	110.2	T190 G194 D195 A216	T190-Q192 PolarHBondContact O-N 3.15Å; Q192-G194 PolarHBondContact O-N 2.95Å; Q192-D195 WeakPolarHBondContact CB-OD2 3.31Å; Q192-D195 PolarHBondContact N-OD2 2.88Å; Q192-D195 WeakPolarHBondContact O-CB 3.34Å; Q192-D195 PolarHBondContact O-N 2.97Å; Q192-D195 VanDerWaalsContact O-N 3.11Å; Q192-A216 WeakPolarHBondContact O-CB 3.36Å
193	R	85.1	Confident	94.1	Very high	192 Å²	192	39.4 Å²	39.4	73%	0.725	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	126.7	177.8	179.4	-180	-73.9	-175.3	-0.5	109.9	D195 S218	R193-D195 VanDerWaalsContact C-N 3.33Å; R193-S218 PolarHBondContact NH2-OG 3.49Å
194	G	85.8	Confident	94	Very high	58 Å²	58	41.5 Å²	41.5	60%	0.598	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.5	-5	178.7	0	0	0	0	0	114.2	Q192 V196	Q192-G194 PolarHBondContact O-N 2.95Å; G194-V196 PolarHBondContact O-N 2.84Å
195	D	91.3	Very high	94	Very high	9 Å²	9	40 Å²	40	5%	0.048	21%	0.211	C	C	.	.			trans	-61.6	137.6	169.7	-80.6	-33.4	0	0	0	110.7	R159 N160 Q192 R193 Y197 A216	R159-D195 IonicContact CZ-OD1 3.11Å; R159-D195 IonicContact CZ-OD2 3.64Å; R159-D195 IonicContact NE-OD1 2.7Å; R159-D195 PolarHBondContact NE-OD1 2.79Å; R159-D195 IonicContact NE-OD2 3.2Å; R159-D195 IonicContact NH2-OD1 3.82Å; R159-D195 PolarHBondContact NH2-OD1 2.86Å; R159-D195 IonicContact NH2-OD2 3.19Å; R159-D195 PolarHBondContact NH2-OD2 2.65Å; N160-D195 PolarHBondContact ND2-OD1 2.91Å; N160-D195 WeakPolarHBondContact OD1-CA 3.49Å; Q192-D195 WeakPolarHBondContact CB-OD2 3.31Å; Q192-D195 PolarHBondContact N-OD2 2.88Å; Q192-D195 WeakPolarHBondContact O-CB 3.34Å; Q192-D195 PolarHBondContact O-N 2.97Å; Q192-D195 VanDerWaalsContact O-N 3.11Å; R193-D195 VanDerWaalsContact C-N 3.33Å; D195-Y197 HydrophobicContact CB-CD2 4.14Å; D195-Y197 HydrophobicContact CB-CE2 3.36Å; D195-Y197 PolarHBondContact OD2-OH 2.98Å; D195-A216 PolarHBondContact O-N 2.9Å
196	V	94.6	Very high	94	Very high	21 Å²	21	41 Å²	41	13%	0.127	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.2	171.5	-173.5	0	0	0	0	108	R159 N160 G194 E213 R215	R159-V196 WeakPolarHBondContact CA-O 3.3Å; N160-V196 PolarHBondContact N-O 2.93Å; N160-V196 PolarHBondContact OD1-N 3.42Å; G194-V196 PolarHBondContact O-N 2.84Å; V196-E213 HydrophobicContact CG1-CB 4.33Å; V196-E213 HydrophobicContact CG1-CG 4.24Å; V196-R215 HydrophobicContact CG1-CG 4.29Å; V196-R215 HydrophobicContact CG2-CG 4.23Å
197	Y	95.7	Very high	94	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	135.6	174.9	-64.3	-93	0	0	0	108.6	L141 F158 R159 L187 M189 D195 E213 W214	L141-Y197 HydrophobicContact CD1-CD1 3.99Å; L141-Y197 HydrophobicContact CD1-CD2 4.04Å; L141-Y197 HydrophobicContact CD1-CG 3.63Å; F158-Y197 CarbonylContact O-C 3.6Å; F158-Y197 WeakPolarHBondContact O-CA 3.3Å; R159-Y197 HydrophobicContact CB-CD1 4.19Å; R159-Y197 HydrophobicContact CB-CE1 4.05Å; R159-Y197 HydrophobicContact CG-CD1 4.19Å; R159-Y197 HydrophobicContact CG-CE1 3.71Å; R159-Y197 PolarHBondContact NE-OH 2.91Å; L187-Y197 HydrophobicContact CD2-CD1 3.71Å; L187-Y197 HydrophobicContact CD2-CE1 4.06Å; M189-Y197 HydrophobicContact CB-CE1 4.21Å; M189-Y197 HydrophobicContact CE-CD1 4.24Å; M189-Y197 HydrophobicContact CE-CD2 3.71Å; M189-Y197 HydrophobicContact CE-CE1 3.66Å; M189-Y197 HydrophobicContact CE-CE2 3.03Å; M189-Y197 HydrophobicContact CE-CG 4.27Å; M189-Y197 VanDerWaalsContact CE-OH 3.28Å; M189-Y197 WeakPolarHBondContact CE-OH 3.42Å; D195-Y197 HydrophobicContact CB-CD2 4.14Å; D195-Y197 HydrophobicContact CB-CE2 3.36Å; D195-Y197 PolarHBondContact OD2-OH 2.98Å; Y197-E213 CarbonylContact O-C 3.46Å; Y197-E213 WeakPolarHBondContact O-CA 3.3Å; Y197-W214 AromaticContact CD2-CE3 3.67Å; Y197-W214 HydrophobicContact CD2-CE3 3.67Å; Y197-W214 AromaticContact CD2-CZ3 3.8Å; Y197-W214 HydrophobicContact CD2-CZ3 3.8Å; Y197-W214 HydrophobicContact CE2-CE3 4.45Å; Y197-W214 HydrophobicContact CE2-CZ3 4.13Å; Y197-W214 HydrophobicContact CG-CE3 4.34Å; Y197-W214 PolarHBondContact N-O 2.92Å; Y197-W214 PolarHBondContact O-N 2.9Å
198	T	97.9	Very high	94	Very high	19 Å²	19	52.7 Å²	52.7	12%	0.117	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.7	-177.5	-50	0	0	0	0	109.6	W157 F158 T211 V212 E213	W157-T198 CarbonylContact C-O 3.54Å; F158-T198 PolarHBondContact N-O 2.71Å; F158-T198 PolarHBondContact O-N 2.83Å; T198-T211 HydrophobicContact CG2-CG2 4.16Å; T198-V212 CarbonylContact C-O 3.56Å; T198-V212 VanDerWaalsContact CA-O 3.29Å; T198-V212 WeakPolarHBondContact CA-O 3.39Å; T198-E213 HydrophobicContact CG2-CG 4.37Å
199	C	98.2	Very high	94.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.3	166.3	-175.2	0	0	0	0	108.7	I127 C143 W157 T211 V212	I127-C199 HydrophobicContact CD1-CB 3.76Å; I127-C199 HydrophobicContact CG1-CB 3.99Å; C143-C199 HydrophobicContact CB-CB 3.67Å; C143-C199 WeakPolarHBondContact CB-SG 3.38Å; C143-C199 WeakPolarHBondContact SG-CB 3.49Å; C143-C199 CovalentContact SG-SG 2.02Å; C143-C199 PolarHBondContact SG-SG 2.94Å; W157-C199 HydrophobicContact CE3-CB 4.36Å; W157-C199 HydrophobicContact CH2-CB 4.21Å; W157-C199 HydrophobicContact CZ3-CB 4.11Å; C199-T211 WeakPolarHBondContact O-CA 3.42Å; C199-V212 PolarHBondContact N-O 2.82Å; C199-V212 PolarHBondContact O-N 3.25Å
200	H	98.4	Very high	94.5	Very high	32 Å²	32	51 Å²	51	15%	0.148	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.1	-176.9	-176.7	166.9	0	0	0	108.8	V155 R156 F158 P209 V210 T211	V155-H200 CarbonylContact C-O 3.56Å; V155-H200 WeakPolarHBondContact CA-O 3.47Å; R156-H200 HydrophobicContact CB-CB 4.45Å; R156-H200 PolarHBondContact N-O 3.49Å; R156-H200 PolarHBondContact NH2-CE1 3.45Å; R156-H200 PolarHBondContact NH2-NE2 3.1Å; R156-H200 PolarHBondContact O-N 3.16Å; F158-H200 HydrophobicContact CD2-CB 3.83Å; F158-H200 HydrophobicContact CE2-CB 3.68Å; F158-H200 AromaticContact CE2-CG 3.92Å; F158-H200 AromaticContact CE2-ND1 3.39Å; F158-H200 WeakPolarHBondContact CE2-ND1 3.43Å; F158-H200 AromaticContact CZ-ND1 3.82Å; H200-P209 VanDerWaalsContact CD2-CB 3.44Å; H200-P209 WeakPolarHBondContact CD2-CB 3.43Å; H200-P209 WeakPolarHBondContact NE2-CB 3.3Å; H200-V210 WeakPolarHBondContact CA-O 3.42Å; H200-T211 HydrophobicContact CB-CG2 4.26Å
201	V	98.6	Very high	94.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125	-176.5	-177.9	0	0	0	0	110.3	P123 V125 V145 I153 V155 P209 V210	P123-V201 HydrophobicContact CB-CG1 4.4Å; P123-V201 HydrophobicContact CG-CG1 3.95Å; V125-V201 HydrophobicContact CG1-CG2 3.94Å; V125-V201 HydrophobicContact CG2-CB 4.13Å; V125-V201 HydrophobicContact CG2-CG1 4.4Å; V125-V201 HydrophobicContact CG2-CG2 3.73Å; V145-V201 HydrophobicContact CG1-CG1 4.06Å; V145-V201 HydrophobicContact CG1-CG2 4.44Å; V145-V201 HydrophobicContact CG2-CG2 3.74Å; I153-V201 HydrophobicContact CD1-CG1 3.94Å; I153-V201 HydrophobicContact CG1-CG1 4.21Å; V155-V201 HydrophobicContact CG1-CG2 4.21Å; V155-V201 HydrophobicContact CG2-CG1 4.42Å; V155-V201 HydrophobicContact CG2-CG2 4.28Å; V201-P209 CarbonylContact O-C 3.6Å; V201-P209 VanDerWaalsContact O-CA 3.32Å; V201-P209 WeakPolarHBondContact O-CA 3.31Å; V201-P209 WeakPolarHBondContact O-CB 3.32Å; V201-V210 PolarHBondContact N-O 3.09Å; V201-V210 PolarHBondContact O-N 3.17Å
202	D	98.4	Very high	95.4	Very high	70 Å²	70	54.7 Å²	54.7	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.2	173.8	-178.4	9.8	0	0	0	108.9	K154	K154-D202 HydrophobicContact CB-CB 4.27Å; K154-D202 PolarHBondContact N-O 3.24Å; K154-D202 PolarHBondContact O-N 3.04Å
203	H	98.5	Very high	95.9	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.009	30%	0.301	C	S	.	.			trans	-154.6	141.4	-172.7	-179	-103	0	0	0	110.3	E121 P123 F148 Y149 P150 Q152 I153 S205 L206	E121-H203 PolarHBondContact O-CE1 2.78Å; E121-H203 VanDerWaalsContact O-CE1 3.26Å; P123-H203 HydrophobicContact CG-CB 4.23Å; F148-H203 AromaticContact CD2-CD2 3.86Å; F148-H203 AromaticContact CD2-NE2 3.7Å; Y149-H203 VanDerWaalsContact C-CE1 3.47Å; Y149-H203 PolarHBondContact O-CE1 2.91Å; P150-H203 PolarHBondContact O-NE2 3.37Å; P150-H203 VanDerWaalsContact O-NE2 3.11Å; Q152-H203 PolarHBondContact O-CD2 3.24Å; I153-H203 HydrophobicContact CG1-CB 4.36Å; H203-S205 PolarHBondContact CE1-OG 2.75Å; H203-S205 WeakPolarHBondContact ND1-CB 3.4Å; H203-S205 PolarHBondContact ND1-N 2.75Å; H203-S205 PolarHBondContact ND1-OG 2.99Å; H203-S205 PolarHBondContact O-N 3.32Å; H203-L206 HydrophobicContact CB-CD1 3.96Å; H203-L206 HydrophobicContact CB-CG 4.23Å; H203-L206 WeakPolarHBondContact O-CB 3.02Å; H203-L206 PolarHBondContact O-N 3.26Å
204	P	97.9	Very high	96.3	Very high	66 Å²	66	47.1 Å²	47.1	43%	0.429	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19	-175.6	-28.2	36.4	0	0	0	116.4	L120 P150 Q152 L206	L120-P204 HydrophobicContact CD2-CB 4.43Å; P150-P204 HydrophobicContact CG-CG 4.4Å; Q152-P204 WeakPolarHBondContact O-CD 3.41Å; P204-L206 VanDerWaalsContact C-N 3.29Å
205	S	97.6	Very high	96.6	Very high	16 Å²	16	51 Å²	51	11%	0.112	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.4	176.1	76.1	0	0	0	0	113.9	E121 Q122 H203	E121-S205 PolarHBondContact O-OG 3.17Å; Q122-S205 VanDerWaalsContact CA-OG 3.3Å; Q122-S205 WeakPolarHBondContact CA-OG 3.05Å; Q122-S205 WeakPolarHBondContact CG-OG 3.23Å; H203-S205 PolarHBondContact CE1-OG 2.75Å; H203-S205 WeakPolarHBondContact ND1-CB 3.4Å; H203-S205 PolarHBondContact ND1-N 2.75Å; H203-S205 PolarHBondContact ND1-OG 2.99Å; H203-S205 PolarHBondContact O-N 3.32Å
206	L	97.7	Very high	96.2	Very high	27 Å²	27	51.1 Å²	51.1	14%	0.141	27%	0.272	C	S	.	.			trans	-103.2	133.7	-175.3	-62.2	173.6	0	0	0	109.9	Q122 P123 H203 P204 S208 V210	Q122-L206 HydrophobicContact CB-CD2 4.21Å; Q122-L206 HydrophobicContact CG-CD2 4.07Å; P123-L206 HydrophobicContact CG-CD1 3.91Å; P123-L206 HydrophobicContact CG-CD2 4.49Å; P123-L206 HydrophobicContact CG-CG 4.38Å; H203-L206 HydrophobicContact CB-CD1 3.96Å; H203-L206 HydrophobicContact CB-CG 4.23Å; H203-L206 WeakPolarHBondContact O-CB 3.02Å; H203-L206 PolarHBondContact O-N 3.26Å; P204-L206 VanDerWaalsContact C-N 3.29Å; L206-S208 VanDerWaalsContact C-N 3.33Å; L206-S208 WeakPolarHBondContact CB-O 3.48Å; L206-V210 HydrophobicContact CD1-CB 4.3Å; L206-V210 HydrophobicContact CD1-CG2 3.79Å; L206-V210 HydrophobicContact CD2-CG2 3.84Å; L206-V210 HydrophobicContact CG-CG2 4.46Å
207	E	96.4	Very high	95	Very high	210 Å²	210	55.9 Å²	55.9	98%	0.981	29%	0.293	S	S	*	.	S	Bend	trans	-71.5	-32.5	172.8	-64.6	-176.9	174.8	0	0	112.1
208	S	96.6	Very high	92.9	Very high	84 Å²	84	57.3 Å²	57.3	59%	0.587	30%	0.304	S	S	*	.	S	Bend	trans	-142.6	153.2	175.2	61.2	0	0	0	0	109.9	L206	L206-S208 VanDerWaalsContact C-N 3.33Å; L206-S208 WeakPolarHBondContact CB-O 3.48Å
209	P	97.1	Very high	90.8	Very high	60 Å²	60	63.4 Å²	63.4	39%	0.39	33%	0.331	S	S	.	.			trans	-62.4	139.5	-176.2	-21.7	32.8	0	0	0	112.7	H200 V201	H200-P209 VanDerWaalsContact CD2-CB 3.44Å; H200-P209 WeakPolarHBondContact CD2-CB 3.43Å; H200-P209 WeakPolarHBondContact NE2-CB 3.3Å; V201-P209 CarbonylContact O-C 3.6Å; V201-P209 VanDerWaalsContact O-CA 3.32Å; V201-P209 WeakPolarHBondContact O-CA 3.31Å; V201-P209 WeakPolarHBondContact O-CB 3.32Å
210	V	97.6	Very high	88.6	Confident	45 Å²	45	65.1 Å²	65.1	27%	0.273	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.5	174.3	170.2	0	0	0	0	108.8	V125 H200 V201 L206 V212	V125-V210 HydrophobicContact CB-CG1 4.16Å; V125-V210 HydrophobicContact CG2-CB 4.46Å; V125-V210 HydrophobicContact CG2-CG1 3.87Å; H200-V210 WeakPolarHBondContact CA-O 3.42Å; V201-V210 PolarHBondContact N-O 3.09Å; V201-V210 PolarHBondContact O-N 3.17Å; L206-V210 HydrophobicContact CD1-CB 4.3Å; L206-V210 HydrophobicContact CD1-CG2 3.79Å; L206-V210 HydrophobicContact CD2-CG2 3.84Å; L206-V210 HydrophobicContact CG-CG2 4.46Å; V210-V212 HydrophobicContact CG1-CG2 4.2Å
211	T	97.1	Very high	86.4	Confident	85 Å²	85	66.4 Å²	66.4	52%	0.521	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.8	174	52.8	0	0	0	0	109.8	T198 C199 H200	T198-T211 HydrophobicContact CG2-CG2 4.16Å; C199-T211 WeakPolarHBondContact O-CA 3.42Å; H200-T211 HydrophobicContact CB-CG2 4.26Å
212	V	97.6	Very high	84.1	Confident	40 Å²	40	73.5 Å²	73.5	24%	0.242	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.2	175.3	-179.9	0	0	0	0	107.7	V125 I127 T198 C199 V210	V125-V212 HydrophobicContact CB-CG2 3.8Å; V125-V212 HydrophobicContact CG1-CB 4.15Å; V125-V212 HydrophobicContact CG1-CG2 3.58Å; I127-V212 HydrophobicContact CD1-CB 4.11Å; I127-V212 HydrophobicContact CD1-CG1 3.93Å; I127-V212 WeakPolarHBondContact CD1-O 3.29Å; I127-V212 HydrophobicContact CG1-CB 4.33Å; I127-V212 HydrophobicContact CG1-CG1 3.97Å; T198-V212 CarbonylContact C-O 3.56Å; T198-V212 VanDerWaalsContact CA-O 3.29Å; T198-V212 WeakPolarHBondContact CA-O 3.39Å; C199-V212 PolarHBondContact N-O 2.82Å; C199-V212 PolarHBondContact O-N 3.25Å; V210-V212 HydrophobicContact CG1-CG2 4.2Å
213	E	96.4	Very high	82.2	Confident	107 Å²	107	73.6 Å²	73.6	50%	0.5	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	142.4	179.9	-64.6	-171.9	170.6	0	0	111.5	V196 Y197 T198 R215	V196-E213 HydrophobicContact CG1-CB 4.33Å; V196-E213 HydrophobicContact CG1-CG 4.24Å; Y197-E213 CarbonylContact O-C 3.46Å; Y197-E213 WeakPolarHBondContact O-CA 3.3Å; T198-E213 HydrophobicContact CG2-CG 4.37Å; E213-R215 IonicContact OE2-CZ 3.96Å; E213-R215 IonicContact OE2-NE 2.81Å; E213-R215 PolarHBondContact OE2-NE 3.11Å; E213-R215 IonicContact OE2-NH2 3.46Å; E213-R215 PolarHBondContact OE2-NH2 2.83Å
214	W	93.8	Very high	80.2	Confident	36 Å²	36	80.5 Å²	80.5	14%	0.136	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.8	165.7	-177.7	90.7	0	0	0	108.9	I127 L129 E133 L141 M189 P191 Y197 A216	I127-W214 HydrophobicContact CB-CB 4.22Å; I127-W214 HydrophobicContact CD1-CB 4.06Å; I127-W214 HydrophobicContact CG2-CB 3.65Å; I127-W214 HydrophobicContact CG2-CG 3.95Å; L129-W214 HydrophobicContact CD1-CZ2 3.65Å; L129-W214 HydrophobicContact CD2-CH2 4.46Å; L129-W214 HydrophobicContact CD2-CZ2 4.11Å; L129-W214 HydrophobicContact CG-CZ2 3.99Å; E133-W214 HydrophobicContact CG-CZ2 4.5Å; E133-W214 WeakPolarHBondContact OE1-CZ2 3.43Å; L141-W214 HydrophobicContact CD1-CD2 4.25Å; L141-W214 HydrophobicContact CD1-CE3 3.74Å; L141-W214 HydrophobicContact CD1-CZ3 4.23Å; L141-W214 HydrophobicContact CD2-CD2 3.64Å; L141-W214 HydrophobicContact CD2-CE3 3.89Å; L141-W214 HydrophobicContact CD2-CG 3.99Å; L141-W214 HydrophobicContact CD2-CZ2 4.42Å; L141-W214 HydrophobicContact CD2-CZ3 4.35Å; L141-W214 HydrophobicContact CG-CE3 4.42Å; M189-W214 HydrophobicContact CE-CZ3 3.96Å; P191-W214 HydrophobicContact CB-CH2 4.25Å; P191-W214 HydrophobicContact CB-CZ3 4.36Å; Y197-W214 AromaticContact CD2-CE3 3.67Å; Y197-W214 HydrophobicContact CD2-CE3 3.67Å; Y197-W214 AromaticContact CD2-CZ3 3.8Å; Y197-W214 HydrophobicContact CD2-CZ3 3.8Å; Y197-W214 HydrophobicContact CE2-CE3 4.45Å; Y197-W214 HydrophobicContact CE2-CZ3 4.13Å; Y197-W214 HydrophobicContact CG-CE3 4.34Å; Y197-W214 PolarHBondContact N-O 2.92Å; Y197-W214 PolarHBondContact O-N 2.9Å; W214-A216 VanDerWaalsContact CH2-CA 3.48Å; W214-A216 HydrophobicContact CH2-CB 3.86Å; W214-A216 HydrophobicContact CZ3-CB 3.89Å
215	R	91.1	Very high	78.4	Confident	139 Å²	139	83.8 Å²	83.8	53%	0.525	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.9	-177.3	-64.3	-179	178.9	-104.4	-4.6	108.9	V196 E213 Q217	V196-R215 HydrophobicContact CG1-CG 4.29Å; V196-R215 HydrophobicContact CG2-CG 4.23Å; E213-R215 IonicContact OE2-CZ 3.96Å; E213-R215 IonicContact OE2-NE 2.81Å; E213-R215 PolarHBondContact OE2-NE 3.11Å; E213-R215 IonicContact OE2-NH2 3.46Å; E213-R215 PolarHBondContact OE2-NH2 2.83Å; R215-Q217 PolarHBondContact O-N 2.03Å
216	A	82.8	Confident	76.8	Confident	12 Å²	12	89.1 Å²	89.1	10%	0.099	47%	0.466	C	S	.	.			trans	-64.5	109.1	173.1	0	0	0	0	0	109.4	E133 L135 P191 Q192 D195 W214	E133-A216 WeakPolarHBondContact OE1-CA 3.21Å; L135-A216 HydrophobicContact CD2-CB 4.07Å; P191-A216 HydrophobicContact CB-CB 3.79Å; Q192-A216 WeakPolarHBondContact O-CB 3.36Å; D195-A216 PolarHBondContact O-N 2.9Å; W214-A216 VanDerWaalsContact CH2-CA 3.48Å; W214-A216 HydrophobicContact CH2-CB 3.86Å; W214-A216 HydrophobicContact CZ3-CB 3.89Å
217	Q	70.4	Confident	75.6	Confident	121 Å²	121	92.1 Å²	92.1	57%	0.565	49%	0.489	S	S	*	.			trans	-86.4	152.1	177.1	-66.6	-155.4	-0.5	0	0	110.3	E133 R215	E133-Q217 PolarHBondContact OE1-N 2.84Å; R215-Q217 PolarHBondContact O-N 2.03Å
218	S	51.4	Low	74.6	Confident	32 Å²	32	84.2 Å²	84.2	22%	0.224	46%	0.464	C	S	.	.			trans	-88	126.4	172.4	-177.7	0	0	0	0	108	R193 S220 A221	R193-S218 PolarHBondContact NH2-OG 3.49Å; S218-S220 PolarHBondContact O-N 3.08Å; S218-S220 VanDerWaalsContact OG-CB 3.24Å; S218-S220 WeakPolarHBondContact OG-CB 3.33Å; S218-S220 PolarHBondContact OG-N 2.89Å; S218-A221 PolarHBondContact O-N 3.4Å
219	E	53.3	Low	73.7	Confident	148 Å²	148	84.9 Å²	84.9	69%	0.692	46%	0.46	S	S	*	.	H	α-helix	trans	-46.2	-26.1	168.2	-74.2	-171.6	142.9	0	0	112.4	A221 Q222 S223	E219-A221 PolarHBondContact O-N 3.02Å; E219-Q222 PolarHBondContact O-N 3.49Å; E219-S223 PolarHBondContact O-N 2.86Å; E219-S223 VanDerWaalsContact O-N 3.1Å; E219-S223 PolarHBondContact O-OG 3.22Å
220	S	51.4	Low	72.9	Confident	36 Å²	36	83.6 Å²	83.6	25%	0.252	46%	0.458	S	S	.	.	H	α-helix	trans	-59.7	-25.8	175.2	179.9	0	0	0	0	114.6	S218 K224	S218-S220 PolarHBondContact O-N 3.08Å; S218-S220 VanDerWaalsContact OG-CB 3.24Å; S218-S220 WeakPolarHBondContact OG-CB 3.33Å; S218-S220 PolarHBondContact OG-N 2.89Å; S220-K224 WeakPolarHBondContact O-CB 3.37Å; S220-K224 VanDerWaalsContact O-CD 3.3Å; S220-K224 WeakPolarHBondContact O-CD 3.23Å; S220-K224 WeakPolarHBondContact O-CG 3.33Å; S220-K224 PolarHBondContact O-N 3.46Å; S220-K224 VanDerWaalsContact OG-CD 3.32Å; S220-K224 WeakPolarHBondContact OG-CD 3.35Å; S220-K224 WeakPolarHBondContact OG-CE 3.5Å; S220-K224 PolarHBondContact OG-NZ 3.46Å
221	A	52	Low	72.3	Confident	59 Å²	59	83.6 Å²	83.6	49%	0.488	47%	0.467	S	S	.	.	H	α-helix	trans	-75.7	-44	-178.6	0	0	0	0	0	111.2	S218 E219 M225	S218-A221 PolarHBondContact O-N 3.4Å; E219-A221 PolarHBondContact O-N 3.02Å; A221-M225 PolarHBondContact O-N 2.9Å
222	Q	51.9	Low	71.8	Confident	148 Å²	148	86.9 Å²	86.9	69%	0.692	48%	0.475	S	S	*	.	H	α-helix	trans	-69.4	-43.3	175.9	-109.9	178.3	-13.8	0	0	112	E219 K224 M225 L226	E219-Q222 PolarHBondContact O-N 3.49Å; Q222-K224 PolarHBondContact O-N 3.26Å; Q222-M225 PolarHBondContact O-N 3.41Å; Q222-L226 WeakPolarHBondContact O-CD1 3.44Å; Q222-L226 PolarHBondContact O-N 3.01Å
223	S	56.6	Low	71.5	Confident	72 Å²	72	88.6 Å²	88.6	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-69.4	-34.9	-179.1	78.9	0	0	0	0	113.1	E219 S227	E219-S223 PolarHBondContact O-N 2.86Å; E219-S223 VanDerWaalsContact O-N 3.1Å; E219-S223 PolarHBondContact O-OG 3.22Å; S223-S227 WeakPolarHBondContact O-CB 3.15Å; S223-S227 PolarHBondContact O-N 3.39Å
224	K	58.3	Low	71.2	Confident	148 Å²	148	88.3 Å²	88.3	64%	0.643	49%	0.486	S	S	*	.	H	α-helix	trans	-68.9	-35.9	174.4	-75.2	175.4	177.2	162.3	0	112.2	S220 Q222 G228	S220-K224 WeakPolarHBondContact O-CB 3.37Å; S220-K224 VanDerWaalsContact O-CD 3.3Å; S220-K224 WeakPolarHBondContact O-CD 3.23Å; S220-K224 WeakPolarHBondContact O-CG 3.33Å; S220-K224 PolarHBondContact O-N 3.46Å; S220-K224 VanDerWaalsContact OG-CD 3.32Å; S220-K224 WeakPolarHBondContact OG-CD 3.35Å; S220-K224 WeakPolarHBondContact OG-CE 3.5Å; S220-K224 PolarHBondContact OG-NZ 3.46Å; Q222-K224 PolarHBondContact O-N 3.26Å; K224-G228 PolarHBondContact O-N 3.15Å
225	M	60.1	Low	71	Confident	135 Å²	135	88.1 Å²	88.1	67%	0.665	50%	0.496	S	S	*	.	H	α-helix	trans	-68.1	-42.1	176	-142.8	178.9	91.4	0	0	111.5	A221 Q222 G228 I229	A221-M225 PolarHBondContact O-N 2.9Å; Q222-M225 PolarHBondContact O-N 3.41Å; M225-G228 PolarHBondContact O-N 2.71Å; M225-I229 HydrophobicContact CE-CD1 4.47Å; M225-I229 WeakPolarHBondContact O-CG1 3.22Å; M225-I229 PolarHBondContact O-N 2.9Å
226	L	62.4	Low	71.1	Confident	128 Å²	128	85.2 Å²	85.2	67%	0.67	49%	0.493	S	S	*	.	H	α-helix	trans	-65.8	-41.6	175.6	-96.3	129.6	0	0	0	113	Q222 G228 G230	Q222-L226 WeakPolarHBondContact O-CD1 3.44Å; Q222-L226 PolarHBondContact O-N 3.01Å; L226-G228 VanDerWaalsContact C-N 3.33Å; L226-G230 PolarHBondContact O-N 3Å
227	S	72.3	Confident	71.6	Confident	89 Å²	89	88.9 Å²	88.9	62%	0.622	51%	0.51	S	S	*	.	H	α-helix	trans	-66.9	-35.3	175	-172.8	0	0	0	0	112.2	S223 G231	S223-S227 WeakPolarHBondContact O-CB 3.15Å; S223-S227 PolarHBondContact O-N 3.39Å; S227-G231 PolarHBondContact O-N 2.89Å
228	G	75.4	Confident	72.5	Confident	44 Å²	44	90.1 Å²	90.1	45%	0.454	51%	0.514	S	S	.	.	H	α-helix	trans	-65.9	-44.7	176.3	0	0	0	0	0	112.6	K224 M225 L226 G231 F232	K224-G228 PolarHBondContact O-N 3.15Å; M225-G228 PolarHBondContact O-N 2.71Å; L226-G228 VanDerWaalsContact C-N 3.33Å; G228-G231 PolarHBondContact O-N 3.09Å; G228-F232 PolarHBondContact O-N 3.22Å
229	I	79.6	Confident	74.4	Confident	98 Å²	98	94.3 Å²	94.3	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-63.9	-44.2	175.8	-66.8	166.3	0	0	0	110.5	M225 G231 F232 V233	M225-I229 HydrophobicContact CE-CD1 4.47Å; M225-I229 WeakPolarHBondContact O-CG1 3.22Å; M225-I229 PolarHBondContact O-N 2.9Å; I229-G231 VanDerWaalsContact C-N 3.35Å; I229-G231 PolarHBondContact O-N 3.3Å; I229-F232 PolarHBondContact O-N 3.39Å; I229-V233 HydrophobicContact CG2-CG2 4.38Å; I229-V233 WeakPolarHBondContact O-CG2 3.46Å; I229-V233 PolarHBondContact O-N 2.68Å
230	G	78.8	Confident	76.2	Confident	34 Å²	34	89.3 Å²	89.3	35%	0.351	52%	0.521	S	S	.	.	H	α-helix	trans	-58.6	-43.8	176.1	0	0	0	0	0	112.9	L226 L234	L226-G230 PolarHBondContact O-N 3Å; G230-L234 WeakPolarHBondContact O-CG 3.35Å; G230-L234 PolarHBondContact O-N 2.91Å; G230-L234 VanDerWaalsContact O-N 3.13Å
231	G	85.3	Confident	78.1	Confident	45 Å²	45	92 Å²	92	46%	0.464	53%	0.532	S	S	.	.	H	α-helix	trans	-65.7	-40.2	176.4	0	0	0	0	0	113.4	S227 G228 I229 L234 G235	S227-G231 PolarHBondContact O-N 2.89Å; G228-G231 PolarHBondContact O-N 3.09Å; I229-G231 VanDerWaalsContact C-N 3.35Å; I229-G231 PolarHBondContact O-N 3.3Å; G231-L234 PolarHBondContact O-N 3.48Å; G231-G235 PolarHBondContact O-N 3.17Å
232	F	87.1	Confident	79.8	Confident	154 Å²	154	91 Å²	91	68%	0.675	53%	0.528	S	S	*	.	H	α-helix	trans	-65.7	-44.9	178.1	-174	-98.6	0	0	0	112	G228 I229 L234 G235 V236	G228-F232 PolarHBondContact O-N 3.22Å; I229-F232 PolarHBondContact O-N 3.39Å; F232-L234 PolarHBondContact O-N 3.23Å; F232-G235 PolarHBondContact O-N 2.76Å; F232-V236 HydrophobicContact CD1-CG2 4.2Å; F232-V236 HydrophobicContact CE1-CG2 3.84Å; F232-V236 HydrophobicContact CZ-CG2 4.07Å; F232-V236 WeakPolarHBondContact O-CG2 3.31Å; F232-V236 PolarHBondContact O-N 3.34Å
233	V	90.5	Very high	81.4	Confident	76 Å²	76	89.2 Å²	89.2	46%	0.461	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-45	177.6	173	0	0	0	0	110.9	I229 G235 V236 I237	I229-V233 HydrophobicContact CG2-CG2 4.38Å; I229-V233 WeakPolarHBondContact O-CG2 3.46Å; I229-V233 PolarHBondContact O-N 2.68Å; V233-G235 VanDerWaalsContact C-N 3.35Å; V233-G235 PolarHBondContact O-N 2.89Å; V233-V236 PolarHBondContact O-N 2.66Å; V233-I237 HydrophobicContact CG1-CD1 4.02Å; V233-I237 WeakPolarHBondContact O-CG1 3.36Å; V233-I237 PolarHBondContact O-N 3.18Å; V233-I237 VanDerWaalsContact O-N 3.12Å
234	L	90.3	Very high	82.8	Confident	100 Å²	100	92.3 Å²	92.3	52%	0.524	53%	0.527	S	S	.	.	H	α-helix	trans	-60.6	-44.2	175.1	-73.3	169.5	0	0	0	111.5	G230 G231 F232 V236 I237 F238	G230-L234 WeakPolarHBondContact O-CG 3.35Å; G230-L234 PolarHBondContact O-N 2.91Å; G230-L234 VanDerWaalsContact O-N 3.13Å; G231-L234 PolarHBondContact O-N 3.48Å; F232-L234 PolarHBondContact O-N 3.23Å; L234-V236 PolarHBondContact O-N 3.43Å; L234-I237 PolarHBondContact O-N 3.25Å; L234-F238 WeakPolarHBondContact O-CD2 3.4Å; L234-F238 PolarHBondContact O-N 3.31Å
235	G	90.3	Very high	84	Confident	33 Å²	33	90.7 Å²	90.7	34%	0.34	53%	0.525	S	S	.	.	H	α-helix	trans	-58.9	-42.8	177.2	0	0	0	0	0	113.6	G231 F232 V233 F238 L239	G231-G235 PolarHBondContact O-N 3.17Å; F232-G235 PolarHBondContact O-N 2.76Å; V233-G235 VanDerWaalsContact C-N 3.35Å; V233-G235 PolarHBondContact O-N 2.89Å; G235-F238 PolarHBondContact O-N 3.22Å; G235-L239 WeakPolarHBondContact O-CB 3.44Å; G235-L239 PolarHBondContact O-N 3.45Å
236	V	93.3	Very high	85	Confident	77 Å²	77	89.1 Å²	89.1	47%	0.467	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-39.5	177.2	174.3	0	0	0	0	111.5	F232 V233 L234 L239 G240	F232-V236 HydrophobicContact CD1-CG2 4.2Å; F232-V236 HydrophobicContact CE1-CG2 3.84Å; F232-V236 HydrophobicContact CZ-CG2 4.07Å; F232-V236 WeakPolarHBondContact O-CG2 3.31Å; F232-V236 PolarHBondContact O-N 3.34Å; V233-V236 PolarHBondContact O-N 2.66Å; L234-V236 PolarHBondContact O-N 3.43Å; V236-L239 PolarHBondContact O-N 3.3Å; V236-G240 PolarHBondContact O-N 3.41Å
237	I	92.3	Very high	85.7	Confident	90 Å²	90	88.8 Å²	88.8	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-46.6	176.6	-68.1	165.4	0	0	0	110.7	V233 L234 G240 L241	V233-I237 HydrophobicContact CG1-CD1 4.02Å; V233-I237 WeakPolarHBondContact O-CG1 3.36Å; V233-I237 PolarHBondContact O-N 3.18Å; V233-I237 VanDerWaalsContact O-N 3.12Å; L234-I237 PolarHBondContact O-N 3.25Å; I237-G240 PolarHBondContact O-N 3.37Å; I237-L241 HydrophobicContact CG2-CD1 3.85Å; I237-L241 WeakPolarHBondContact O-CB 3.48Å; I237-L241 WeakPolarHBondContact O-CG 3.47Å; I237-L241 PolarHBondContact O-N 3.32Å
238	F	91	Very high	85.8	Confident	146 Å²	146	91.6 Å²	91.6	64%	0.64	51%	0.511	S	S	*	.	H	α-helix	trans	-64.5	-39.7	178	-79.9	-68.9	0	0	0	112.6	L234 G235 G242	L234-F238 WeakPolarHBondContact O-CD2 3.4Å; L234-F238 PolarHBondContact O-N 3.31Å; G235-F238 PolarHBondContact O-N 3.22Å; F238-G242 PolarHBondContact O-N 3.24Å
239	L	91.3	Very high	85.4	Confident	121 Å²	121	94 Å²	94	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-63.1	-45.3	174.2	-86.9	161.9	0	0	0	112	G235 V236 G242 L243	G235-L239 WeakPolarHBondContact O-CB 3.44Å; G235-L239 PolarHBondContact O-N 3.45Å; V236-L239 PolarHBondContact O-N 3.3Å; L239-G242 PolarHBondContact O-N 3.31Å; L239-L243 WeakPolarHBondContact O-CB 3.44Å; L239-L243 WeakPolarHBondContact O-CG 3.48Å; L239-L243 PolarHBondContact O-N 3.11Å
240	G	89.6	Confident	84.7	Confident	42 Å²	42	96.1 Å²	96.1	43%	0.433	53%	0.529	S	S	.	.	H	α-helix	trans	-61.4	-45.7	176.8	0	0	0	0	0	112.5	V236 I237 L243 F244	V236-G240 PolarHBondContact O-N 3.41Å; I237-G240 PolarHBondContact O-N 3.37Å; G240-L243 PolarHBondContact O-N 3.5Å; G240-F244 WeakPolarHBondContact O-CB 3.33Å; G240-F244 PolarHBondContact O-N 3.12Å
241	L	91.1	Very high	83.8	Confident	92 Å²	92	102.6 Å²	102.6	48%	0.482	55%	0.547	S	S	.	.	H	α-helix	trans	-63	-43.1	175.4	-77.2	165.7	0	0	0	111.9	I237 F244 I245	I237-L241 HydrophobicContact CG2-CD1 3.85Å; I237-L241 WeakPolarHBondContact O-CB 3.48Å; I237-L241 WeakPolarHBondContact O-CG 3.47Å; I237-L241 PolarHBondContact O-N 3.32Å; L241-F244 PolarHBondContact O-N 3.07Å; L241-I245 WeakPolarHBondContact O-CG1 3.47Å; L241-I245 PolarHBondContact O-N 2.9Å
242	G	87.9	Confident	82.2	Confident	40 Å²	40	103 Å²	103	41%	0.412	55%	0.551	S	S	.	*	H	α-helix	trans	-60.4	-46.2	176.7	0	0	0	0	0	112.5	F238 L239 I245 H246	F238-G242 PolarHBondContact O-N 3.24Å; L239-G242 PolarHBondContact O-N 3.31Å; G242-I245 PolarHBondContact O-N 2.78Å; G242-H246 WeakPolarHBondContact O-CB 3.38Å; G242-H246 PolarHBondContact O-N 3.05Å
243	L	87.1	Confident	80.7	Confident	110 Å²	110	102 Å²	102	58%	0.576	56%	0.561	S	S	*	*	H	α-helix	trans	-64.2	-39.6	176.3	-73.5	170.4	0	0	0	112.2	L239 G240 H246 H247	L239-L243 WeakPolarHBondContact O-CB 3.44Å; L239-L243 WeakPolarHBondContact O-CG 3.48Å; L239-L243 PolarHBondContact O-N 3.11Å; G240-L243 PolarHBondContact O-N 3.5Å; L243-H246 PolarHBondContact O-N 3.27Å; L243-H247 WeakPolarHBondContact O-CB 3.28Å; L243-H247 PolarHBondContact O-N 2.83Å
244	F	85.1	Confident	78.9	Confident	137 Å²	137	110.6 Å²	110.6	60%	0.601	59%	0.585	S	S	*	*	H	α-helix	trans	-63.5	-45.9	177	-178.2	-99.1	0	0	0	112.2	G240 L241 H247 K248	G240-F244 WeakPolarHBondContact O-CB 3.33Å; G240-F244 PolarHBondContact O-N 3.12Å; L241-F244 PolarHBondContact O-N 3.07Å; F244-H247 PolarHBondContact O-N 3.04Å; F244-K248 WeakPolarHBondContact O-CB 3.34Å; F244-K248 PolarHBondContact O-N 3.2Å
245	I	84.4	Confident	77.1	Confident	114 Å²	114	108.8 Å²	108.8	59%	0.585	59%	0.59	S	S	*	*	H	α-helix	trans	-63.8	-42.9	176.4	-66.2	169.2	0	0	0	110.3	L241 G242 K248 S249	L241-I245 WeakPolarHBondContact O-CG1 3.47Å; L241-I245 PolarHBondContact O-N 2.9Å; G242-I245 PolarHBondContact O-N 2.78Å; I245-K248 PolarHBondContact O-N 3.37Å; I245-S249 WeakPolarHBondContact O-CB 3.24Å; I245-S249 PolarHBondContact O-N 3.18Å
246	H	80.4	Confident	75.5	Confident	101 Å²	101	112.9 Å²	112.9	47%	0.468	61%	0.611	S	S	.	*	H	α-helix	trans	-61.6	-46.3	177.8	-170.4	70.4	0	0	0	112.2	G242 L243 K248 S249 Q250	G242-H246 WeakPolarHBondContact O-CB 3.38Å; G242-H246 PolarHBondContact O-N 3.05Å; L243-H246 PolarHBondContact O-N 3.27Å; H246-K248 VanDerWaalsContact C-N 3.31Å; H246-K248 PolarHBondContact O-N 3.08Å; H246-S249 WeakPolarHBondContact O-CB 3.46Å; H246-S249 PolarHBondContact O-N 2.84Å; H246-Q250 PolarHBondContact NE2-NE2 3.28Å; H246-Q250 PolarHBondContact O-N 3.32Å
247	H	76	Confident	73.7	Confident	122 Å²	122	114.9 Å²	114.9	57%	0.565	63%	0.626	S	S	*	*	H	α-helix	trans	-62.8	-35.2	175	-95.6	-132.7	0	0	0	112.9	L243 F244 K251	L243-H247 WeakPolarHBondContact O-CB 3.28Å; L243-H247 PolarHBondContact O-N 2.83Å; F244-H247 PolarHBondContact O-N 3.04Å; H247-K251 PolarHBondContact O-N 3.44Å
248	K	75	Confident	71.7	Confident	148 Å²	148	117 Å²	117	64%	0.643	65%	0.645	S	S	*	*	H	α-helix	trans	-73.1	-34.5	176.5	-154.4	-176.5	-179.1	-177.3	0	111.7	F244 I245 H246 K251	F244-K248 WeakPolarHBondContact O-CB 3.34Å; F244-K248 PolarHBondContact O-N 3.2Å; I245-K248 PolarHBondContact O-N 3.37Å; H246-K248 VanDerWaalsContact C-N 3.31Å; H246-K248 PolarHBondContact O-N 3.08Å; K248-K251 CarbonylContact O-C 3.52Å; K248-K251 PolarHBondContact O-N 3.21Å
249	S	67.3	Low	69.8	Low	95 Å²	95	115.2 Å²	115.2	66%	0.664	66%	0.657	S	S	*	*	H	α-helix	trans	-66.7	-34	173.9	179.8	0	0	0	0	112.9	I245 H246 K251	I245-S249 WeakPolarHBondContact O-CB 3.24Å; I245-S249 PolarHBondContact O-N 3.18Å; H246-S249 WeakPolarHBondContact O-CB 3.46Å; H246-S249 PolarHBondContact O-N 2.84Å; S249-K251 PolarHBondContact O-N 2.93Å
250	Q	64.8	Low	67.5	Low	142 Å²	142	113 Å²	113	66%	0.664	66%	0.664	S	S	*	*	H	α-helix	trans	-73.5	-16.1	174.5	-68.5	-158.7	8.8	0	0	112.9	H246 G252	H246-Q250 PolarHBondContact NE2-NE2 3.28Å; H246-Q250 PolarHBondContact O-N 3.32Å; Q250-G252 PolarHBondContact O-N 3.09Å
251	K	60.5	Low	65.5	Low	169 Å²	169	118.6 Å²	118.6	74%	0.735	68%	0.683	S	S	*	*	S	Bend	trans	-95.7	71.5	170.7	-65.7	-178.5	-177.5	-177.5	0	109.8	H247 K248 S249	H247-K251 PolarHBondContact O-N 3.44Å; K248-K251 CarbonylContact O-C 3.52Å; K248-K251 PolarHBondContact O-N 3.21Å; S249-K251 PolarHBondContact O-N 2.93Å
252	G	52.2	Low	63.3	Low	53 Å²	53	121.6 Å²	121.6	55%	0.546	70%	0.698	S	S	.	*			trans	-58.6	155.4	172.2	0	0	0	0	0	112.6	Q250 R254	Q250-G252 PolarHBondContact O-N 3.09Å; G252-R254 PolarHBondContact O-N 2.95Å
253	P	55.3	Low	61.1	Low	135 Å²	135	132.5 Å²	132.5	88%	0.877	74%	0.739	S	S	*	*			trans	-66.9	129.5	-175.7	-10.8	25.4	0	0	0	110.9	G255	P253-G255 PolarHBondContact O-N 2.93Å; P253-G255 VanDerWaalsContact O-N 3.07Å
254	R	52.3	Low	59.8	Low	255 Å²	255	133.7 Å²	133.7	96%	0.962	75%	0.747	S	S	*	*			trans	-70.1	101.9	162.9	-68.8	-176.3	-162.7	163.1	4	107.5	G252	G252-R254 PolarHBondContact O-N 2.95Å
255	G	52.9	Low	58.4	Low	62 Å²	62	133.5 Å²	133.5	64%	0.639	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-63	147.9	173.2	0	0	0	0	0	111.5	P253	P253-G255 PolarHBondContact O-N 2.93Å; P253-G255 VanDerWaalsContact O-N 3.07Å
256	P	56.6	Low	57	Low	120 Å²	120	134.6 Å²	134.6	78%	0.779	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-76.3	151.8	177.8	29	-26.8	0	0	0	111.3
257	P	54.5	Low	55.6	Low	119 Å²	119	136.5 Å²	136.5	77%	0.773	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-74.1	147.7	-178.7	30.2	-32.9	0	0	0	111.6
258	P	50.3	Low	54.4	Low	135 Å²	135	137.4 Å²	137.4	88%	0.877	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-76.2	133.8	177.1	29.8	-31.4	0	0	0	111.1
259	A	50.8	Low	53	Low	108 Å²	108	136.7 Å²	136.7	89%	0.893	81%	0.805	S	S	*	*			trans	-114	126.9	165.1	0	0	0	0	0	109.2
260	G	44.4	Very low	52	Low	74 Å²	74	139.7 Å²	139.7	76%	0.763	82%	0.815	S	S	*	*			trans	178.5	92.4	174.4	0	0	0	0	0	106.3
261	L	47.4	Very low	51	Low	159 Å²	159	139.5 Å²	139.5	83%	0.832	83%	0.827	S	S	*	*				81.6	106.7	59.2	-142.4	148.3	0	0	0	112.3
262	L	43.3	Very low	50.2	Low	155 Å²	155	137.1 Å²	137.1	81%	0.812	84%	0.835	S	S	*	*			trans	49	138.3	153.8	-59.7	172.6	0	0	0	122.1
263	Q	42.3	Very low	50	Low	270 Å²	270	144.7 Å²	144.7	100%	1.262	86%	0.861	S	S	*	*			trans	83.2	0	165.9	-87.3	173.9	-30.4	0	0	118.3

Retrieved 263 of 263 residues in 283.2 ms (Link to these results)

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