X5DNQ0_HUMAN Loading...

MHC class II antigen

AlphaFold DB (P01911), UniProt , Accession X5DNQ0, Species HUMAN (Homo sapiens, Human), Gene HLA-DRB1, Length 266 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	41.2	Very low	49.7	Very low	247 Å²	247	137 Å²	137	100%	1.217	83%	0.83	S	S	*	*				0	103.2	0	-86.3	172	164.7	0	0	108
2	V	39	Very low	51.1	Low	143 Å²	143	137.8 Å²	137.8	87%	0.867	82%	0.821	S	S	*	*			trans	-111.5	113.4	176.7	177.1	0	0	0	0	107.3
3	C	38.6	Very low	51.9	Low	124 Å²	124	133.5 Å²	133.5	84%	0.838	80%	0.797	S	S	*	*			trans	-73.4	120.6	172.8	-86.7	0	0	0	0	109.8
4	L	43	Very low	53	Low	171 Å²	171	127.9 Å²	127.9	90%	0.895	77%	0.772	S	S	*	*			trans	-76.7	114.8	165.3	-90.1	135.1	0	0	0	109.4
5	K	49.3	Very low	54.1	Low	205 Å²	205	125.7 Å²	125.7	89%	0.891	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-78.4	124.9	167.2	-81.6	-170.2	173.5	-178.7	0	109.7
6	L	49.6	Very low	55.2	Low	168 Å²	168	122.3 Å²	122.3	88%	0.88	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-69.2	134.4	169.3	-78.3	148.9	0	0	0	110.2
7	P	50.9	Low	56.1	Low	116 Å²	116	120.2 Å²	120.2	75%	0.753	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-79.9	131.4	-175.1	31.2	-31.1	0	0	0	111.3	G9	P7-G9 PolarHBondContact O-N 3.5Å
8	G	55	Low	56.7	Low	94 Å²	94	117.9 Å²	117.9	97%	0.969	71%	0.708	S	S	*	*	S	Bend	trans	-71.2	42.4	-177.7	0	0	0	0	0	116
9	G	57.8	Low	57.4	Low	51 Å²	51	117.5 Å²	117.5	53%	0.526	70%	0.702	S	S	.	*			trans	-102.6	-3.6	-177.3	0	0	0	0	0	116.1	P7 T13	P7-G9 PolarHBondContact O-N 3.5Å; G9-T13 PolarHBondContact O-OG1 2.88Å
10	S	59.8	Low	58.1	Low	95 Å²	95	118.1 Å²	118.1	66%	0.664	70%	0.698	S	S	*	*	H	α-helix	trans	-79.7	-29.4	-167.5	-175.5	0	0	0	0	115	T13 A14	S10-T13 PolarHBondContact O-OG1 3.03Å; S10-A14 PolarHBondContact O-N 3.48Å
11	C	62.8	Low	58.4	Low	93 Å²	93	117.1 Å²	117.1	63%	0.628	69%	0.693	S	S	*	*	H	α-helix	trans	-75.1	-38.1	-173.7	-163.3	0	0	0	0	112.7	A14 L15	C11-A14 PolarHBondContact O-N 3.46Å; C11-L15 WeakPolarHBondContact O-CB 3.35Å; C11-L15 PolarHBondContact O-N 2.88Å
12	M	66.2	Low	59.5	Low	146 Å²	146	111.9 Å²	111.9	72%	0.719	67%	0.669	S	S	*	*	H	α-helix	trans	-68.6	-35.9	179.8	-79.7	-70.9	-75.8	0	0	112.5	T16	M12-T16 PolarHBondContact O-N 3.16Å; M12-T16 PolarHBondContact O-OG1 3.11Å
13	T	61.5	Low	60.7	Low	83 Å²	83	108.9 Å²	108.9	51%	0.509	66%	0.655	S	S	.	*	H	α-helix	trans	-69.7	-42	175.1	18.6	0	0	0	0	111.9	G9 S10 L15 T16 V17	G9-T13 PolarHBondContact O-OG1 2.88Å; S10-T13 PolarHBondContact O-OG1 3.03Å; T13-L15 PolarHBondContact O-N 2.77Å; T13-T16 WeakPolarHBondContact CA-OG1 3.4Å; T13-T16 PolarHBondContact O-N 2.95Å; T13-T16 PolarHBondContact O-OG1 2.93Å; T13-T16 VanDerWaalsContact O-OG1 3.13Å; T13-V17 VanDerWaalsContact O-CG2 3.27Å; T13-V17 WeakPolarHBondContact O-CG2 3.47Å; T13-V17 PolarHBondContact O-N 3.08Å
14	A	67	Low	61.7	Low	54 Å²	54	105.2 Å²	105.2	45%	0.446	63%	0.631	S	S	.	*	H	α-helix	trans	-62.5	-41.7	174.5	0	0	0	0	0	112.2	S10 C11 T18	S10-A14 PolarHBondContact O-N 3.48Å; C11-A14 PolarHBondContact O-N 3.46Å; A14-T18 WeakPolarHBondContact O-CB 3.44Å; A14-T18 PolarHBondContact O-N 2.86Å; A14-T18 PolarHBondContact O-OG1 3.12Å
15	L	70.2	Confident	62.4	Low	95 Å²	95	102.4 Å²	102.4	50%	0.497	62%	0.622	S	S	.	*	H	α-helix	trans	-64.7	-42.7	176.3	-100.2	151.7	0	0	0	112.9	C11 T13 T18 L19	C11-L15 WeakPolarHBondContact O-CB 3.35Å; C11-L15 PolarHBondContact O-N 2.88Å; T13-L15 PolarHBondContact O-N 2.77Å; L15-T18 PolarHBondContact O-N 2.95Å; L15-L19 WeakPolarHBondContact O-CB 3.14Å; L15-L19 PolarHBondContact O-N 2.97Å
16	T	71.8	Confident	62.8	Low	71 Å²	71	99.5 Å²	99.5	44%	0.436	62%	0.616	S	S	.	*	H	α-helix	trans	-66.3	-40	177.4	26.5	0	0	0	0	112.3	M12 T13 L19 M20	M12-T16 PolarHBondContact O-N 3.16Å; M12-T16 PolarHBondContact O-OG1 3.11Å; T13-T16 WeakPolarHBondContact CA-OG1 3.4Å; T13-T16 PolarHBondContact O-N 2.95Å; T13-T16 PolarHBondContact O-OG1 2.93Å; T13-T16 VanDerWaalsContact O-OG1 3.13Å; T16-L19 PolarHBondContact O-N 3.12Å; T16-M20 WeakPolarHBondContact O-CG 3.22Å; T16-M20 PolarHBondContact O-N 2.76Å
17	V	69.3	Low	63	Low	88 Å²	88	95.3 Å²	95.3	53%	0.533	61%	0.606	S	S	.	*	H	α-helix	trans	-64.2	-42.8	175.3	173.5	0	0	0	0	110.9	T13 L19 M20 V21	T13-V17 VanDerWaalsContact O-CG2 3.27Å; T13-V17 WeakPolarHBondContact O-CG2 3.47Å; T13-V17 PolarHBondContact O-N 3.08Å; V17-L19 PolarHBondContact O-N 3.23Å; V17-M20 PolarHBondContact O-N 3.39Å; V17-V21 WeakPolarHBondContact O-CG2 3.44Å; V17-V21 PolarHBondContact O-N 3.28Å
18	T	67.4	Low	63.4	Low	78 Å²	78	97.5 Å²	97.5	48%	0.479	61%	0.61	S	S	.	*	H	α-helix	trans	-65.5	-40.8	178.8	-48.3	0	0	0	0	111.6	A14 L15 V21 L22	A14-T18 WeakPolarHBondContact O-CB 3.44Å; A14-T18 PolarHBondContact O-N 2.86Å; A14-T18 PolarHBondContact O-OG1 3.12Å; L15-T18 PolarHBondContact O-N 2.95Å; T18-V21 PolarHBondContact O-N 2.99Å; T18-L22 HydrophobicContact CG2-CD1 4.03Å; T18-L22 WeakPolarHBondContact O-CB 3.4Å; T18-L22 WeakPolarHBondContact O-CG 3.49Å; T18-L22 PolarHBondContact O-N 3.39Å
19	L	70.2	Confident	63.6	Low	111 Å²	111	96.1 Å²	96.1	58%	0.581	59%	0.586	S	S	*	*	H	α-helix	trans	-62.8	-42.5	173.2	-104.2	137.3	0	0	0	111.9	L15 T16 V17 V21 L22 S23	L15-L19 WeakPolarHBondContact O-CB 3.14Å; L15-L19 PolarHBondContact O-N 2.97Å; T16-L19 PolarHBondContact O-N 3.12Å; V17-L19 PolarHBondContact O-N 3.23Å; L19-V21 VanDerWaalsContact C-N 3.34Å; L19-V21 PolarHBondContact O-N 3.41Å; L19-L22 PolarHBondContact O-N 3.21Å; L19-S23 VanDerWaalsContact O-CB 3.26Å; L19-S23 WeakPolarHBondContact O-CB 3.1Å; L19-S23 PolarHBondContact O-N 3.37Å; L19-S23 PolarHBondContact O-OG 3.48Å
20	M	70.6	Confident	64.2	Low	128 Å²	128	96.4 Å²	96.4	63%	0.631	59%	0.589	S	S	*	*	H	α-helix	trans	-65.3	-33.9	176.9	-74.6	-157.9	-126	0	0	113.3	T16 V17 S24	T16-M20 WeakPolarHBondContact O-CG 3.22Å; T16-M20 PolarHBondContact O-N 2.76Å; V17-M20 PolarHBondContact O-N 3.39Å; M20-S24 PolarHBondContact O-N 3.04Å; M20-S24 PolarHBondContact O-OG 3.41Å
21	V	65.4	Low	65.2	Low	98 Å²	98	95.6 Å²	95.6	59%	0.594	58%	0.577	S	S	*	*	H	α-helix	trans	-71.4	-42.4	175.7	173.7	0	0	0	0	111	V17 T18 L19 S24	V17-V21 WeakPolarHBondContact O-CG2 3.44Å; V17-V21 PolarHBondContact O-N 3.28Å; T18-V21 PolarHBondContact O-N 2.99Å; L19-V21 VanDerWaalsContact C-N 3.34Å; L19-V21 PolarHBondContact O-N 3.41Å; V21-S24 WeakPolarHBondContact O-CB 3.47Å; V21-S24 PolarHBondContact O-N 3.2Å; V21-S24 PolarHBondContact O-OG 3.19Å
22	L	64	Low	66.3	Low	137 Å²	137	97 Å²	97	72%	0.717	58%	0.583	S	S	*	*	H	α-helix	trans	-74.5	-27.1	178.3	-74.1	165.4	0	0	0	113.6	T18 L19	T18-L22 HydrophobicContact CG2-CD1 4.03Å; T18-L22 WeakPolarHBondContact O-CB 3.4Å; T18-L22 WeakPolarHBondContact O-CG 3.49Å; T18-L22 PolarHBondContact O-N 3.39Å; L19-L22 PolarHBondContact O-N 3.21Å
23	S	64.6	Low	67.5	Low	80 Å²	80	98.4 Å²	98.4	56%	0.559	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	8.3	174.2	58.9	0	0	0	0	113.3	L19 P25	L19-S23 VanDerWaalsContact O-CB 3.26Å; L19-S23 WeakPolarHBondContact O-CB 3.1Å; L19-S23 PolarHBondContact O-N 3.37Å; L19-S23 PolarHBondContact O-OG 3.48Å; S23-P25 VanDerWaalsContact O-CD 3.25Å; S23-P25 WeakPolarHBondContact O-CD 3.39Å; S23-P25 VanDerWaalsContact O-N 3.14Å
24	S	58.6	Low	68.9	Low	48 Å²	48	99.3 Å²	99.3	34%	0.336	59%	0.587	S	S	.	*			trans	-58.6	118.2	171.8	-79.6	0	0	0	0	109.1	M20 V21 L26 A27	M20-S24 PolarHBondContact O-N 3.04Å; M20-S24 PolarHBondContact O-OG 3.41Å; V21-S24 WeakPolarHBondContact O-CB 3.47Å; V21-S24 PolarHBondContact O-N 3.2Å; V21-S24 PolarHBondContact O-OG 3.19Å; S24-L26 PolarHBondContact O-N 2.99Å; S24-A27 PolarHBondContact O-N 2.94Å
25	P	58.8	Low	70.2	Confident	111 Å²	111	106 Å²	106	72%	0.721	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-55.1	-20.4	-177.9	-24.6	32.5	0	0	0	113.7	S23 A27 L28 S29	S23-P25 VanDerWaalsContact O-CD 3.25Å; S23-P25 WeakPolarHBondContact O-CD 3.39Å; S23-P25 VanDerWaalsContact O-N 3.14Å; P25-A27 VanDerWaalsContact C-N 3.31Å; P25-A27 PolarHBondContact O-N 3.06Å; P25-L28 PolarHBondContact O-N 3.5Å; P25-S29 PolarHBondContact O-N 3.33Å
26	L	56.8	Low	71.4	Confident	144 Å²	144	108.2 Å²	108.2	75%	0.754	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-66.4	-25	176.7	-71.8	155.2	0	0	0	113.7	S24 L28 S29	S24-L26 PolarHBondContact O-N 2.99Å; L26-L28 VanDerWaalsContact C-N 3.32Å; L26-S29 PolarHBondContact O-OG 2.88Å
27	A	55.2	Low	72.6	Confident	81 Å²	81	109.2 Å²	109.2	67%	0.669	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-78.2	-19.3	176.8	0	0	0	0	0	112.8	S24 P25	S24-A27 PolarHBondContact O-N 2.94Å; P25-A27 VanDerWaalsContact C-N 3.31Å; P25-A27 PolarHBondContact O-N 3.06Å
28	L	58.1	Low	73.9	Confident	161 Å²	161	112.3 Å²	112.3	84%	0.843	61%	0.611	S	S	*	*	S	Bend	trans	-100.9	-3.7	176.9	-116	79.5	0	0	0	113.4	P25 L26 G30	P25-L28 PolarHBondContact O-N 3.5Å; L26-L28 VanDerWaalsContact C-N 3.32Å; L28-G30 PolarHBondContact O-N 3.47Å
29	S	60.6	Low	75.3	Confident	65 Å²	65	111.8 Å²	111.8	46%	0.455	60%	0.604	S	S	.	*			trans	-73.7	94.6	178.5	64	0	0	0	0	109.4	P25 L26	P25-S29 PolarHBondContact O-N 3.33Å; L26-S29 PolarHBondContact O-OG 2.88Å
30	G	69.5	Low	76.6	Confident	57 Å²	57	109.4 Å²	109.4	59%	0.588	59%	0.594	S	S	*	*			trans	-52.5	161.1	158.1	0	0	0	0	0	110.6	L28 T32	L28-G30 PolarHBondContact O-N 3.47Å; G30-T32 VanDerWaalsContact O-CG2 3.29Å; G30-T32 WeakPolarHBondContact O-CG2 3.31Å; G30-T32 PolarHBondContact O-N 3.34Å
31	D	81.1	Confident	77.9	Confident	78 Å²	78	107.9 Å²	107.9	42%	0.417	58%	0.584	S	S	.	*			trans	-43.4	109.1	-176.4	-179.1	11.6	0	0	0	113.4	R33	D31-R33 VanDerWaalsContact C-N 3.34Å; D31-R33 VanDerWaalsContact CG-NE 3.27Å; D31-R33 VanDerWaalsContact OD1-CB 3.31Å; D31-R33 WeakPolarHBondContact OD1-CB 3.42Å; D31-R33 WeakPolarHBondContact OD1-CG 3.4Å; D31-R33 IonicContact OD1-CZ 3.89Å; D31-R33 PolarHBondContact OD1-N 2.98Å; D31-R33 VanDerWaalsContact OD1-N 3.12Å; D31-R33 IonicContact OD1-NE 2.73Å; D31-R33 PolarHBondContact OD1-NE 2.95Å; D31-R33 IonicContact OD1-NH2 2.7Å; D31-R33 IonicContact OD2-CZ 3.76Å; D31-R33 IonicContact OD2-NE 3.63Å; D31-R33 PolarHBondContact OD2-NE 3.49Å; D31-R33 IonicContact OD2-NH2 3.73Å; D31-R33 PolarHBondContact OD2-NH2 3.36Å
32	T	85	Confident	79.5	Confident	123 Å²	123	109.9 Å²	109.9	76%	0.755	58%	0.581	S	S	*	*			trans	-90.4	7.8	-175.4	55.8	0	0	0	0	113.3	G30	G30-T32 VanDerWaalsContact O-CG2 3.29Å; G30-T32 WeakPolarHBondContact O-CG2 3.31Å; G30-T32 PolarHBondContact O-N 3.34Å
33	R	92	Very high	81.1	Confident	175 Å²	175	105.5 Å²	105.5	66%	0.66	56%	0.557	S	S	*	*			trans	-57.6	142.6	176.5	-73.5	178.6	-68.6	-179	0.4	110.8	D31 R35	D31-R33 VanDerWaalsContact C-N 3.34Å; D31-R33 VanDerWaalsContact CG-NE 3.27Å; D31-R33 VanDerWaalsContact OD1-CB 3.31Å; D31-R33 WeakPolarHBondContact OD1-CB 3.42Å; D31-R33 WeakPolarHBondContact OD1-CG 3.4Å; D31-R33 IonicContact OD1-CZ 3.89Å; D31-R33 PolarHBondContact OD1-N 2.98Å; D31-R33 VanDerWaalsContact OD1-N 3.12Å; D31-R33 IonicContact OD1-NE 2.73Å; D31-R33 PolarHBondContact OD1-NE 2.95Å; D31-R33 IonicContact OD1-NH2 2.7Å; D31-R33 IonicContact OD2-CZ 3.76Å; D31-R33 IonicContact OD2-NE 3.63Å; D31-R33 PolarHBondContact OD2-NE 3.49Å; D31-R33 IonicContact OD2-NH2 3.73Å; D31-R33 PolarHBondContact OD2-NH2 3.36Å; R33-R35 PolarHBondContact O-N 2.86Å
34	P	91.8	Very high	82.8	Confident	102 Å²	102	103.3 Å²	103.3	66%	0.662	54%	0.541	S	S	*	.			trans	-59.1	139.5	177	26.1	-34.3	0	0	0	110.2	F36	P34-F36 HydrophobicContact CB-CE2 4.1Å; P34-F36 HydrophobicContact CB-CZ 3.99Å; P34-F36 HydrophobicContact CG-CE2 4.28Å; P34-F36 HydrophobicContact CG-CZ 4.42Å
35	R	93	Very high	84.7	Confident	194 Å²	194	104.3 Å²	104.3	73%	0.732	54%	0.541	S	S	*	.			trans	-115.2	136.7	179.8	-62.7	-176.9	-174.4	-167	1.5	109.5	R33	R33-R35 PolarHBondContact O-N 2.86Å
36	F	95.1	Very high	86.6	Confident	143 Å²	143	102.5 Å²	102.5	63%	0.627	52%	0.522	S	S	*	.			trans	-124	134.5	177.2	-52.5	-76.8	0	0	0	107.5	P34 Y61	P34-F36 HydrophobicContact CB-CE2 4.1Å; P34-F36 HydrophobicContact CB-CZ 3.99Å; P34-F36 HydrophobicContact CG-CE2 4.28Å; P34-F36 HydrophobicContact CG-CZ 4.42Å; F36-Y61 WeakPolarHBondContact CD1-OH 2.92Å
37	L	97	Very high	88.5	Confident	91 Å²	91	100.6 Å²	100.6	48%	0.476	51%	0.507	S	S	.	.			trans	-133.5	128.2	-177.6	180	61.8	0	0	0	109.1	Q39 N62	L37-Q39 HydrophobicContact CD1-CG 4.07Å; L37-Q39 HydrophobicContact CD2-CG 4.01Å; L37-Q39 HydrophobicContact CG-CG 3.72Å; L37-N62 PolarHBondContact N-OD1 3.01Å; L37-N62 VanDerWaalsContact N-OD1 3.09Å; L37-N62 WeakPolarHBondContact O-CA 3.15Å; L37-N62 PolarHBondContact O-N 3.44Å
38	W	96.7	Very high	90.5	Very high	154 Å²	154	103.2 Å²	103.2	58%	0.583	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.6	172.7	-176.9	88.4	0	0	0	108.8	P40 Y59 F60	W38-P40 HydrophobicContact CE3-CG 4.36Å; W38-P40 HydrophobicContact CH2-CB 4.07Å; W38-P40 HydrophobicContact CH2-CG 3.99Å; W38-P40 HydrophobicContact CZ3-CB 4.19Å; W38-P40 HydrophobicContact CZ3-CG 3.63Å; W38-Y59 AromaticContact CH2-CD1 3.91Å; W38-Y59 HydrophobicContact CH2-CD1 3.91Å; W38-Y59 AromaticContact CH2-CE1 3.84Å; W38-Y59 HydrophobicContact CH2-CE1 3.84Å; W38-Y59 AromaticContact CZ2-CD1 3.32Å; W38-Y59 HydrophobicContact CZ2-CD1 3.32Å; W38-Y59 AromaticContact CZ2-CE1 3.63Å; W38-Y59 HydrophobicContact CZ2-CE1 3.63Å; W38-F60 WeakPolarHBondContact CA-O 3.14Å
39	Q	97.4	Very high	92.3	Very high	67 Å²	67	97.1 Å²	97.1	31%	0.313	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	118.4	-173.4	-58	175.4	81.1	0	0	110.5	L37 F60 N62	L37-Q39 HydrophobicContact CD1-CG 4.07Å; L37-Q39 HydrophobicContact CD2-CG 4.01Å; L37-Q39 HydrophobicContact CG-CG 3.72Å; Q39-F60 HydrophobicContact CB-CB 4.28Å; Q39-F60 PolarHBondContact N-O 3.46Å; Q39-F60 WeakPolarHBondContact O-CD2 3.08Å; Q39-F60 PolarHBondContact O-N 3.47Å; Q39-N62 PolarHBondContact NE2-O 2.87Å
40	P	97.5	Very high	94	Very high	60 Å²	60	96.5 Å²	96.5	39%	0.39	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	142.9	166	34	-30	0	0	0	110.6	W38 R58 Y59	W38-P40 HydrophobicContact CE3-CG 4.36Å; W38-P40 HydrophobicContact CH2-CB 4.07Å; W38-P40 HydrophobicContact CH2-CG 3.99Å; W38-P40 HydrophobicContact CZ3-CB 4.19Å; W38-P40 HydrophobicContact CZ3-CG 3.63Å; P40-R58 CarbonylContact C-O 3.55Å; P40-R58 WeakPolarHBondContact CA-O 3.48Å; P40-Y59 HydrophobicContact CB-CD1 4.15Å; P40-Y59 HydrophobicContact CB-CE1 4.09Å
41	K	98.4	Very high	95.3	Very high	96 Å²	96	100.6 Å²	100.6	42%	0.417	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	115.3	171.5	-65.8	-174.5	179.5	177.4	0	110.1	E43 R58 F60	K41-E43 HydrophobicContact CB-CG 4.33Å; K41-R58 HydrophobicContact CB-CB 4.39Å; K41-R58 PolarHBondContact N-O 3.32Å; K41-R58 PolarHBondContact O-N 2.84Å; K41-F60 HydrophobicContact CB-CE2 4.2Å; K41-F60 HydrophobicContact CD-CE2 3.81Å; K41-F60 HydrophobicContact CD-CZ 4.31Å; K41-F60 HydrophobicContact CG-CD2 4.45Å; K41-F60 HydrophobicContact CG-CE2 4.01Å
42	R	98.3	Very high	96.1	Very high	141 Å²	141	103.9 Å²	103.9	53%	0.532	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	102.6	172.6	-70.2	179.7	-159.5	138	4.3	109.1	F55 L56 D57 Y107	R42-F55 HydrophobicContact CB-CE2 4Å; R42-F55 HydrophobicContact CB-CZ 4.42Å; R42-F55 HydrophobicContact CG-CE2 4.3Å; R42-F55 HydrophobicContact CG-CZ 4.22Å; R42-L56 CarbonylContact C-O 3.52Å; R42-L56 WeakPolarHBondContact CA-O 3.44Å; R42-D57 VanDerWaalsContact CG-OD1 3.27Å; R42-D57 WeakPolarHBondContact CG-OD1 3.33Å; R42-D57 IonicContact NE-OD2 3.88Å; R42-Y107 HydrophobicContact CB-CE1 4.01Å
43	E	98.7	Very high	96.8	Very high	45 Å²	45	98.5 Å²	98.5	21%	0.21	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.1	-173.9	-52.4	178.2	-172.4	0	0	110.2	K41 H45 F55 L56 R58	K41-E43 HydrophobicContact CB-CG 4.33Å; E43-H45 IonicContact OE2-CE1 3.48Å; E43-H45 IonicContact OE2-NE2 3.96Å; E43-H45 PolarHBondContact OE2-NE2 2.89Å; E43-F55 WeakPolarHBondContact O-CA 3.34Å; E43-F55 WeakPolarHBondContact O-CD2 3.45Å; E43-L56 HydrophobicContact CB-CB 4.23Å; E43-L56 PolarHBondContact N-O 3.06Å; E43-L56 PolarHBondContact O-N 3.33Å; E43-R58 WeakPolarHBondContact OE1-CD 3.28Å; E43-R58 IonicContact OE1-CZ 2.65Å; E43-R58 IonicContact OE1-NE 2.65Å; E43-R58 IonicContact OE1-NH1 3.44Å; E43-R58 PolarHBondContact OE1-NH1 2.86Å; E43-R58 IonicContact OE2-NH1 3.88Å
44	C	98.7	Very high	97.1	Very high	34 Å²	34	93.8 Å²	93.8	23%	0.23	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	114.9	171.9	-64.9	0	0	0	0	108.6	F46 Y107 C108	C44-F46 HydrophobicContact CB-CD2 4.39Å; C44-F46 HydrophobicContact CB-CE1 4.37Å; C44-F46 HydrophobicContact CB-CE2 3.51Å; C44-F46 HydrophobicContact CB-CZ 3.5Å; C44-F46 WeakPolarHBondContact O-CD2 3.47Å; C44-F46 WeakPolarHBondContact O-CE2 3.36Å; C44-Y107 VanDerWaalsContact SG-CD1 3.56Å; C44-C108 HydrophobicContact CB-CB 3.62Å; C44-C108 WeakPolarHBondContact CB-SG 3.3Å; C44-C108 WeakPolarHBondContact SG-CA 3.42Å; C44-C108 WeakPolarHBondContact SG-CB 3.26Å; C44-C108 CovalentContact SG-SG 2.04Å; C44-C108 PolarHBondContact SG-SG 2.73Å
45	H	98.5	Very high	97.4	Very high	69 Å²	69	89.2 Å²	89.2	32%	0.319	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118	178.4	-65	-98.6	0	0	0	108.9	E43 F47 V53 R54	E43-H45 IonicContact OE2-CE1 3.48Å; E43-H45 IonicContact OE2-NE2 3.96Å; E43-H45 PolarHBondContact OE2-NE2 2.89Å; H45-F47 HydrophobicContact CB-CE2 3.81Å; H45-F47 HydrophobicContact CB-CZ 4.13Å; H45-V53 WeakPolarHBondContact O-CA 3.46Å; H45-R54 HydrophobicContact CB-CB 4.28Å; H45-R54 PolarHBondContact N-O 2.93Å; H45-R54 PolarHBondContact O-N 3.44Å
46	F	98.4	Very high	97.7	Very high	73 Å²	73	80.4 Å²	80.4	32%	0.32	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.7	-173.3	-62.6	-77.8	0	0	0	110.6	C44 G49 T50 V53 C108 Y112	C44-F46 HydrophobicContact CB-CD2 4.39Å; C44-F46 HydrophobicContact CB-CE1 4.37Å; C44-F46 HydrophobicContact CB-CE2 3.51Å; C44-F46 HydrophobicContact CB-CZ 3.5Å; C44-F46 WeakPolarHBondContact O-CD2 3.47Å; C44-F46 WeakPolarHBondContact O-CE2 3.36Å; F46-G49 WeakPolarHBondContact CB-O 3.3Å; F46-T50 HydrophobicContact CD1-CG2 4.19Å; F46-T50 HydrophobicContact CE1-CG2 4.44Å; F46-V53 HydrophobicContact CD1-CG1 4.24Å; F46-V53 HydrophobicContact CD1-CG2 3.84Å; F46-V53 HydrophobicContact CE1-CG1 4.09Å; F46-V53 HydrophobicContact CE1-CG2 4.18Å; F46-C108 HydrophobicContact CE1-CB 4.1Å; F46-C108 HydrophobicContact CZ-CB 4.08Å; F46-C108 WeakPolarHBondContact CZ-O 3.45Å; F46-Y112 HydrophobicContact CB-CD2 4.42Å; F46-Y112 HydrophobicContact CB-CE2 4.23Å; F46-Y112 AromaticContact CD1-CD2 3.49Å; F46-Y112 HydrophobicContact CD1-CD2 3.49Å; F46-Y112 VanDerWaalsContact CD1-CD2 3.49Å; F46-Y112 HydrophobicContact CD1-CE2 4.07Å; F46-Y112 HydrophobicContact CD1-CG 4.2Å; F46-Y112 AromaticContact CD2-CD2 3.92Å; F46-Y112 HydrophobicContact CD2-CD2 3.92Å; F46-Y112 HydrophobicContact CD2-CE2 4.38Å; F46-Y112 AromaticContact CE1-CD2 3.58Å; F46-Y112 HydrophobicContact CE1-CD2 3.58Å; F46-Y112 AromaticContact CE1-CG 3.97Å; F46-Y112 HydrophobicContact CE1-CG 3.97Å; F46-Y112 AromaticContact CE2-CD2 3.98Å; F46-Y112 HydrophobicContact CE2-CD2 3.98Å; F46-Y112 AromaticContact CG-CD2 3.67Å; F46-Y112 HydrophobicContact CG-CD2 3.67Å; F46-Y112 AromaticContact CG-CE2 3.97Å; F46-Y112 HydrophobicContact CG-CE2 3.97Å; F46-Y112 AromaticContact CZ-CD2 3.82Å; F46-Y112 HydrophobicContact CZ-CD2 3.82Å; F46-Y112 HydrophobicContact CZ-CG 4.3Å
47	F	98.3	Very high	97.9	Very high	103 Å²	103	74.3 Å²	74.3	45%	0.452	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.1	179.5	-55.8	-90.8	0	0	0	109.7	H45 G49 R52 R54	H45-F47 HydrophobicContact CB-CE2 3.81Å; H45-F47 HydrophobicContact CB-CZ 4.13Å; F47-G49 PolarHBondContact O-N 3.49Å; F47-R52 HydrophobicContact CB-CB 4.23Å; F47-R52 HydrophobicContact CD2-CG 4.23Å; F47-R52 PolarHBondContact N-O 3.47Å; F47-R52 PolarHBondContact O-N 3.37Å; F47-R54 HydrophobicContact CE2-CB 4.47Å
48	N	96.9	Very high	97.9	Very high	136 Å²	136	72.6 Å²	72.6	73%	0.727	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	56.8	-175.5	-164.4	32.4	0	0	0	112.4	T50 E51	N48-T50 PolarHBondContact O-N 3.08Å; N48-E51 PolarHBondContact ND2-OE2 3.24Å
49	G	94.8	Very high	98	Very high	33 Å²	33	66.7 Å²	66.7	34%	0.34	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	-122.6	-168.4	0	0	0	0	0	110.7	F46 F47	F46-G49 WeakPolarHBondContact CB-O 3.3Å; F47-G49 PolarHBondContact O-N 3.49Å
50	T	97.5	Very high	98.1	Very high	52 Å²	52	64.4 Å²	64.4	32%	0.319	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	13.4	-178.9	56.6	0	0	0	0	113.6	F46 N48 R109 Y112	F46-T50 HydrophobicContact CD1-CG2 4.19Å; F46-T50 HydrophobicContact CE1-CG2 4.44Å; N48-T50 PolarHBondContact O-N 3.08Å; T50-R109 PolarHBondContact O-NE 2.88Å; T50-Y112 HydrophobicContact CG2-CD1 3.33Å; T50-Y112 HydrophobicContact CG2-CD2 3.92Å; T50-Y112 HydrophobicContact CG2-CE1 3.68Å; T50-Y112 HydrophobicContact CG2-CE2 4.21Å; T50-Y112 HydrophobicContact CG2-CG 3.46Å; T50-Y112 VanDerWaalsContact CG2-CG 3.46Å
51	E	97.2	Very high	98.1	Very high	144 Å²	144	65.8 Å²	65.8	67%	0.673	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-57.1	179.1	-176.1	-178.6	-174	0	0	110.5	N48 R109	N48-E51 PolarHBondContact ND2-OE2 3.24Å; E51-R109 PolarHBondContact O-NH2 2.77Å
52	R	97.9	Very high	97.9	Very high	146 Å²	146	64.1 Å²	64.1	55%	0.551	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.4	169.7	179.3	178.5	179.1	174.7	-0.4	109.8	F47 D72	F47-R52 HydrophobicContact CB-CB 4.23Å; F47-R52 HydrophobicContact CD2-CG 4.23Å; F47-R52 PolarHBondContact N-O 3.47Å; F47-R52 PolarHBondContact O-N 3.37Å; R52-D72 IonicContact NH2-OD2 2.68Å; R52-D72 PolarHBondContact NH2-OD2 3.36Å
53	V	98.6	Very high	97.8	Very high	10 Å²	10	66.1 Å²	66.1	6%	0.061	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.8	178.4	-179.8	0	0	0	0	108.5	H45 F46 V104 C108 R109	H45-V53 WeakPolarHBondContact O-CA 3.46Å; F46-V53 HydrophobicContact CD1-CG1 4.24Å; F46-V53 HydrophobicContact CD1-CG2 3.84Å; F46-V53 HydrophobicContact CE1-CG1 4.09Å; F46-V53 HydrophobicContact CE1-CG2 4.18Å; V53-V104 HydrophobicContact CB-CG1 3.65Å; V53-V104 HydrophobicContact CG1-CG1 3.83Å; V53-C108 HydrophobicContact CG1-CB 3.51Å; V53-R109 HydrophobicContact CG2-CG 3.98Å
54	R	98.6	Very high	97.8	Very high	77 Å²	77	68.5 Å²	68.5	29%	0.291	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.2	173.4	-178.5	-177.5	179.4	-162.5	5.9	109.5	H45 F47 L56 D70 S71 D72	H45-R54 HydrophobicContact CB-CB 4.28Å; H45-R54 PolarHBondContact N-O 2.93Å; H45-R54 PolarHBondContact O-N 3.44Å; F47-R54 HydrophobicContact CE2-CB 4.47Å; R54-L56 HydrophobicContact CG-CD2 4.32Å; R54-D70 IonicContact CZ-OD1 2.84Å; R54-D70 IonicContact CZ-OD2 3.23Å; R54-D70 IonicContact NE-OD1 2.65Å; R54-D70 PolarHBondContact NE-OD1 3.33Å; R54-D70 IonicContact NE-OD2 2.81Å; R54-D70 PolarHBondContact NE-OD2 3.3Å; R54-D70 IonicContact NH2-OD1 2.79Å; R54-D70 IonicContact NH2-OD2 3.85Å; R54-D70 PolarHBondContact NH2-OD2 2.97Å; R54-S71 WeakPolarHBondContact CA-OG 3.37Å; R54-D72 IonicContact NE-OD2 2.72Å
55	F	98.8	Very high	97.8	Very high	5 Å²	5	68 Å²	68	2%	0.022	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.1	176.9	175.2	-112.4	0	0	0	110	R42 E43 D57 F69 S71 A103 V104 Y107	R42-F55 HydrophobicContact CB-CE2 4Å; R42-F55 HydrophobicContact CB-CZ 4.42Å; R42-F55 HydrophobicContact CG-CE2 4.3Å; R42-F55 HydrophobicContact CG-CZ 4.22Å; E43-F55 WeakPolarHBondContact O-CA 3.34Å; E43-F55 WeakPolarHBondContact O-CD2 3.45Å; F55-D57 HydrophobicContact CE1-CB 3.88Å; F55-D57 HydrophobicContact CZ-CB 3.85Å; F55-F69 AromaticContact CD1-CD1 3.8Å; F55-F69 HydrophobicContact CD1-CD1 3.8Å; F55-F69 AromaticContact CD1-CE1 3.93Å; F55-F69 HydrophobicContact CD1-CE1 3.93Å; F55-F69 HydrophobicContact CE1-CD1 4.06Å; F55-F69 HydrophobicContact CE1-CE1 4.47Å; F55-S71 PolarHBondContact N-OG 2.76Å; F55-S71 PolarHBondContact O-N 2.85Å; F55-A103 HydrophobicContact CD1-CB 3.52Å; F55-A103 HydrophobicContact CD2-CB 4.27Å; F55-A103 HydrophobicContact CE1-CB 3.5Å; F55-A103 VanDerWaalsContact CE1-CB 3.5Å; F55-A103 HydrophobicContact CE2-CB 4.24Å; F55-A103 HydrophobicContact CG-CB 3.91Å; F55-A103 HydrophobicContact CZ-CB 3.88Å; F55-V104 HydrophobicContact CB-CG2 3.99Å; F55-Y107 HydrophobicContact CD2-CD1 4.25Å; F55-Y107 AromaticContact CE2-CD1 3.86Å; F55-Y107 HydrophobicContact CE2-CD1 3.86Å; F55-Y107 HydrophobicContact CE2-CE1 4.13Å
56	L	98.8	Very high	97.7	Very high	10 Å²	10	64.9 Å²	64.9	5%	0.052	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.4	171.2	-55.2	179.1	0	0	0	109.4	R42 E43 R54 R58 F69 D70	R42-L56 CarbonylContact C-O 3.52Å; R42-L56 WeakPolarHBondContact CA-O 3.44Å; E43-L56 HydrophobicContact CB-CB 4.23Å; E43-L56 PolarHBondContact N-O 3.06Å; E43-L56 PolarHBondContact O-N 3.33Å; R54-L56 HydrophobicContact CG-CD2 4.32Å; L56-R58 HydrophobicContact CB-CG 3.99Å; L56-F69 VanDerWaalsContact CA-O 3.31Å; L56-F69 WeakPolarHBondContact CA-O 3.33Å; L56-D70 HydrophobicContact CD2-CB 3.68Å; L56-D70 WeakPolarHBondContact CD2-OD1 3.32Å
57	D	98.5	Very high	97.7	Very high	15 Å²	15	61.4 Å²	61.4	8%	0.08	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	106.8	167.6	-154.6	-7.6	0	0	0	108.9	R42 F55 Y59 R68 F69	R42-D57 VanDerWaalsContact CG-OD1 3.27Å; R42-D57 WeakPolarHBondContact CG-OD1 3.33Å; R42-D57 IonicContact NE-OD2 3.88Å; F55-D57 HydrophobicContact CE1-CB 3.88Å; F55-D57 HydrophobicContact CZ-CB 3.85Å; D57-Y59 HydrophobicContact CB-CE2 4.39Å; D57-R68 CarbonylContact O-C 3.55Å; D57-R68 VanDerWaalsContact O-CA 3.25Å; D57-R68 WeakPolarHBondContact O-CA 3.49Å; D57-F69 HydrophobicContact CB-CB 4.04Å; D57-F69 PolarHBondContact N-O 2.98Å; D57-F69 PolarHBondContact O-N 3.37Å
58	R	98.6	Very high	97.8	Very high	54 Å²	54	60.3 Å²	60.3	20%	0.204	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.3	-167	-54.8	174.9	71.2	-170.2	3.6	110.3	P40 K41 E43 L56 F60 E65 R68	P40-R58 CarbonylContact C-O 3.55Å; P40-R58 WeakPolarHBondContact CA-O 3.48Å; K41-R58 HydrophobicContact CB-CB 4.39Å; K41-R58 PolarHBondContact N-O 3.32Å; K41-R58 PolarHBondContact O-N 2.84Å; E43-R58 WeakPolarHBondContact OE1-CD 3.28Å; E43-R58 IonicContact OE1-CZ 2.65Å; E43-R58 IonicContact OE1-NE 2.65Å; E43-R58 IonicContact OE1-NH1 3.44Å; E43-R58 PolarHBondContact OE1-NH1 2.86Å; E43-R58 IonicContact OE2-NH1 3.88Å; L56-R58 HydrophobicContact CB-CG 3.99Å; R58-F60 HydrophobicContact CB-CD2 4.42Å; R58-F60 HydrophobicContact CB-CE2 3.58Å; R58-F60 HydrophobicContact CB-CZ 4.16Å; R58-E65 WeakPolarHBondContact CG-OE1 3.44Å; R58-E65 IonicContact CZ-OE1 3.71Å; R58-E65 IonicContact CZ-OE2 2.97Å; R58-E65 VanDerWaalsContact NE-CD 3.31Å; R58-E65 IonicContact NE-OE1 3.73Å; R58-E65 PolarHBondContact NE-OE1 3.44Å; R58-E65 IonicContact NE-OE2 3.43Å; R58-E65 PolarHBondContact NE-OE2 3.25Å; R58-E65 IonicContact NH2-OE1 2.86Å; R58-E65 IonicContact NH2-OE2 2.95Å; R58-E65 PolarHBondContact NH2-OE2 2.89Å; R58-R68 HydrophobicContact CG-CG 4.01Å
59	Y	98.3	Very high	97.9	Very high	30 Å²	30	53.8 Å²	53.8	12%	0.118	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	128.4	-178.4	-66.4	-92.4	0	0	0	110.7	W38 P40 D57 E65 S66 V67 F76 W90	W38-Y59 AromaticContact CH2-CD1 3.91Å; W38-Y59 HydrophobicContact CH2-CD1 3.91Å; W38-Y59 AromaticContact CH2-CE1 3.84Å; W38-Y59 HydrophobicContact CH2-CE1 3.84Å; W38-Y59 AromaticContact CZ2-CD1 3.32Å; W38-Y59 HydrophobicContact CZ2-CD1 3.32Å; W38-Y59 AromaticContact CZ2-CE1 3.63Å; W38-Y59 HydrophobicContact CZ2-CE1 3.63Å; P40-Y59 HydrophobicContact CB-CD1 4.15Å; P40-Y59 HydrophobicContact CB-CE1 4.09Å; D57-Y59 HydrophobicContact CB-CE2 4.39Å; Y59-E65 CarbonylContact O-C 3.54Å; Y59-E65 WeakPolarHBondContact O-CA 3.4Å; Y59-S66 PolarHBondContact O-N 3.46Å; Y59-S66 PolarHBondContact O-OG 3.37Å; Y59-V67 HydrophobicContact CD2-CG1 4Å; Y59-V67 HydrophobicContact CG-CG1 4.09Å; Y59-V67 PolarHBondContact N-O 2.87Å; Y59-F76 HydrophobicContact CE2-CE1 4.24Å; Y59-W90 HydrophobicContact CD1-CH2 4.09Å; Y59-W90 AromaticContact CD2-CH2 3.76Å; Y59-W90 HydrophobicContact CD2-CH2 3.76Å; Y59-W90 AromaticContact CD2-CZ3 3.67Å; Y59-W90 HydrophobicContact CD2-CZ3 3.67Å; Y59-W90 AromaticContact CE1-CH2 3.95Å; Y59-W90 HydrophobicContact CE1-CH2 3.95Å; Y59-W90 AromaticContact CE2-CH2 3.66Å; Y59-W90 HydrophobicContact CE2-CH2 3.66Å; Y59-W90 AromaticContact CE2-CZ3 3.57Å; Y59-W90 HydrophobicContact CE2-CZ3 3.57Å; Y59-W90 AromaticContact CG-CH2 3.96Å; Y59-W90 HydrophobicContact CG-CH2 3.96Å; Y59-W90 HydrophobicContact CG-CZ3 4.29Å; Y59-W90 AromaticContact CZ-CH2 3.73Å
60	F	98.5	Very high	98	Very high	19 Å²	19	52.8 Å²	52.8	8%	0.083	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.1	-176	-60	-102.4	0	0	0	111.3	W38 Q39 K41 R58 E64 E65	W38-F60 WeakPolarHBondContact CA-O 3.14Å; Q39-F60 HydrophobicContact CB-CB 4.28Å; Q39-F60 PolarHBondContact N-O 3.46Å; Q39-F60 WeakPolarHBondContact O-CD2 3.08Å; Q39-F60 PolarHBondContact O-N 3.47Å; K41-F60 HydrophobicContact CB-CE2 4.2Å; K41-F60 HydrophobicContact CD-CE2 3.81Å; K41-F60 HydrophobicContact CD-CZ 4.31Å; K41-F60 HydrophobicContact CG-CD2 4.45Å; K41-F60 HydrophobicContact CG-CE2 4.01Å; R58-F60 HydrophobicContact CB-CD2 4.42Å; R58-F60 HydrophobicContact CB-CE2 3.58Å; R58-F60 HydrophobicContact CB-CZ 4.16Å; F60-E64 CarbonylContact C-O 3.46Å; F60-E64 VanDerWaalsContact CA-O 3.22Å; F60-E64 WeakPolarHBondContact CA-O 3.49Å; F60-E65 HydrophobicContact CD1-CB 3.75Å; F60-E65 HydrophobicContact CD1-CG 4.45Å; F60-E65 HydrophobicContact CE1-CB 3.56Å; F60-E65 HydrophobicContact CE1-CG 4.11Å; F60-E65 HydrophobicContact CG-CB 4.49Å; F60-E65 HydrophobicContact CZ-CB 4.15Å; F60-E65 HydrophobicContact CZ-CG 4.19Å
61	Y	97.2	Very high	98.1	Very high	90 Å²	90	51.7 Å²	51.7	35%	0.353	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.3	161.4	-174.8	-110	0	0	0	108.7	F36 Q63 E64 L82	F36-Y61 WeakPolarHBondContact CD1-OH 2.92Å; Y61-Q63 PolarHBondContact O-N 3.29Å; Y61-E64 PolarHBondContact N-O 3.39Å; Y61-E64 PolarHBondContact O-N 2.89Å; Y61-L82 HydrophobicContact CD1-CD2 4.02Å; Y61-L82 HydrophobicContact CG-CD2 4.06Å
62	N	95.6	Very high	98.1	Very high	60 Å²	60	48.9 Å²	48.9	32%	0.321	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	-104.7	-163.4	-58.8	-43.8	0	0	0	111.4	L37 Q39	L37-N62 PolarHBondContact N-OD1 3.01Å; L37-N62 VanDerWaalsContact N-OD1 3.09Å; L37-N62 WeakPolarHBondContact O-CA 3.15Å; L37-N62 PolarHBondContact O-N 3.44Å; Q39-N62 PolarHBondContact NE2-O 2.87Å
63	Q	96	Very high	98.2	Very high	184 Å²	184	45.8 Å²	45.8	86%	0.86	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.4	-0.4	176.6	-63.5	178.9	2.7	0	0	112.3	Y61	Y61-Q63 PolarHBondContact O-N 3.29Å
64	E	97.8	Very high	98.1	Very high	94 Å²	94	45.9 Å²	45.9	44%	0.439	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.2	179.5	-173.7	-176.8	157.3	0	0	109.5	F60 Y61 S66 T80	F60-E64 CarbonylContact C-O 3.46Å; F60-E64 VanDerWaalsContact CA-O 3.22Å; F60-E64 WeakPolarHBondContact CA-O 3.49Å; Y61-E64 PolarHBondContact N-O 3.39Å; Y61-E64 PolarHBondContact O-N 2.89Å; E64-S66 PolarHBondContact O-N 3.39Å; E64-T80 HydrophobicContact CG-CG2 3.84Å; E64-T80 WeakPolarHBondContact OE1-CB 3.04Å; E64-T80 WeakPolarHBondContact OE1-CG2 3.46Å; E64-T80 PolarHBondContact OE1-OG1 3.17Å
65	E	98.4	Very high	98.1	Very high	23 Å²	23	45 Å²	45	11%	0.107	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	115.6	169.4	-173.4	176.9	-166.9	0	0	108.7	R58 Y59 F60 R68 V79 T80	R58-E65 WeakPolarHBondContact CG-OE1 3.44Å; R58-E65 IonicContact CZ-OE1 3.71Å; R58-E65 IonicContact CZ-OE2 2.97Å; R58-E65 VanDerWaalsContact NE-CD 3.31Å; R58-E65 IonicContact NE-OE1 3.73Å; R58-E65 PolarHBondContact NE-OE1 3.44Å; R58-E65 IonicContact NE-OE2 3.43Å; R58-E65 PolarHBondContact NE-OE2 3.25Å; R58-E65 IonicContact NH2-OE1 2.86Å; R58-E65 IonicContact NH2-OE2 2.95Å; R58-E65 PolarHBondContact NH2-OE2 2.89Å; Y59-E65 CarbonylContact O-C 3.54Å; Y59-E65 WeakPolarHBondContact O-CA 3.4Å; F60-E65 HydrophobicContact CD1-CB 3.75Å; F60-E65 HydrophobicContact CD1-CG 4.45Å; F60-E65 HydrophobicContact CE1-CB 3.56Å; F60-E65 HydrophobicContact CE1-CG 4.11Å; F60-E65 HydrophobicContact CG-CB 4.49Å; F60-E65 HydrophobicContact CZ-CB 4.15Å; F60-E65 HydrophobicContact CZ-CG 4.19Å; E65-R68 WeakPolarHBondContact OE1-CD 3.43Å; E65-R68 IonicContact OE1-NH1 2.92Å; E65-R68 IonicContact OE2-NH1 3.69Å; E65-V79 HydrophobicContact CB-CG1 4.24Å; E65-V79 HydrophobicContact CG-CB 4.25Å; E65-V79 HydrophobicContact CG-CG1 4.3Å; E65-V79 HydrophobicContact CG-CG2 3.99Å; E65-V79 WeakPolarHBondContact O-CB 3.34Å; E65-V79 WeakPolarHBondContact O-CG1 3.49Å; E65-T80 WeakPolarHBondContact O-CG2 3.31Å
66	S	97.9	Very high	98.1	Very high	5 Å²	5	45 Å²	45	4%	0.035	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-41.6	-175.9	59.6	0	0	0	0	112.6	Y59 E64 V79 T80 G83	Y59-S66 PolarHBondContact O-N 3.46Å; Y59-S66 PolarHBondContact O-OG 3.37Å; E64-S66 PolarHBondContact O-N 3.39Å; S66-V79 PolarHBondContact O-N 2.82Å; S66-T80 PolarHBondContact O-N 2.91Å; S66-G83 WeakPolarHBondContact O-CA 3.47Å
67	V	98.5	Very high	98.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	145.4	-176.9	58.6	0	0	0	0	110.9	Y59 F76 R77 D86 A87 W90	Y59-V67 HydrophobicContact CD2-CG1 4Å; Y59-V67 HydrophobicContact CG-CG1 4.09Å; Y59-V67 PolarHBondContact N-O 2.87Å; V67-F76 HydrophobicContact CG2-CB 4.21Å; V67-F76 HydrophobicContact CG2-CD1 4.3Å; V67-R77 WeakPolarHBondContact CA-O 3.3Å; V67-D86 HydrophobicContact CG1-CB 4.09Å; V67-D86 HydrophobicContact CG2-CB 4.49Å; V67-A87 HydrophobicContact CG2-CB 4Å; V67-W90 HydrophobicContact CB-CZ3 4.37Å; V67-W90 HydrophobicContact CG1-CE3 4.42Å; V67-W90 HydrophobicContact CG1-CH2 3.87Å; V67-W90 HydrophobicContact CG1-CZ3 3.47Å; V67-W90 VanDerWaalsContact CG1-CZ3 3.47Å; V67-W90 HydrophobicContact CG2-CE3 4.14Å; V67-W90 HydrophobicContact CG2-CZ3 3.92Å
68	R	98.7	Very high	98.1	Very high	79 Å²	79	52.7 Å²	52.7	30%	0.298	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	134.5	-178.7	175.3	176.2	62.1	-153.3	-0.4	112.5	D57 R58 E65 F76 R77 V79	D57-R68 CarbonylContact O-C 3.55Å; D57-R68 VanDerWaalsContact O-CA 3.25Å; D57-R68 WeakPolarHBondContact O-CA 3.49Å; R58-R68 HydrophobicContact CG-CG 4.01Å; E65-R68 WeakPolarHBondContact OE1-CD 3.43Å; E65-R68 IonicContact OE1-NH1 2.92Å; E65-R68 IonicContact OE2-NH1 3.69Å; R68-F76 CarbonylContact O-C 3.52Å; R68-F76 WeakPolarHBondContact O-CA 3.46Å; R68-R77 PolarHBondContact N-O 3.13Å; R68-R77 PolarHBondContact O-N 2.9Å; R68-V79 HydrophobicContact CB-CG2 3.92Å
69	F	98.8	Very high	98.1	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.9	155.9	-178.6	-90.8	0	0	0	109.9	F55 L56 D57 F76 L97 A100 R101	F55-F69 AromaticContact CD1-CD1 3.8Å; F55-F69 HydrophobicContact CD1-CD1 3.8Å; F55-F69 AromaticContact CD1-CE1 3.93Å; F55-F69 HydrophobicContact CD1-CE1 3.93Å; F55-F69 HydrophobicContact CE1-CD1 4.06Å; F55-F69 HydrophobicContact CE1-CE1 4.47Å; L56-F69 VanDerWaalsContact CA-O 3.31Å; L56-F69 WeakPolarHBondContact CA-O 3.33Å; D57-F69 HydrophobicContact CB-CB 4.04Å; D57-F69 PolarHBondContact N-O 2.98Å; D57-F69 PolarHBondContact O-N 3.37Å; F69-F76 HydrophobicContact CB-CD1 3.62Å; F69-F76 HydrophobicContact CB-CD2 4.42Å; F69-F76 HydrophobicContact CB-CE1 3.52Å; F69-F76 HydrophobicContact CB-CE2 4.3Å; F69-F76 HydrophobicContact CB-CG 4.11Å; F69-F76 HydrophobicContact CB-CZ 3.87Å; F69-F76 HydrophobicContact CD2-CD2 4Å; F69-F76 AromaticContact CD2-CE2 3.94Å; F69-F76 HydrophobicContact CD2-CE2 3.94Å; F69-F76 HydrophobicContact CD2-CG 4.37Å; F69-F76 HydrophobicContact CD2-CZ 4.28Å; F69-F76 HydrophobicContact CG-CE1 4.47Å; F69-F76 HydrophobicContact CG-CE2 4.48Å; F69-F76 HydrophobicContact CG-CZ 4.37Å; F69-L97 HydrophobicContact CE2-CD1 4.07Å; F69-A100 HydrophobicContact CD1-CB 4.01Å; F69-A100 HydrophobicContact CD2-CB 3.62Å; F69-A100 HydrophobicContact CE1-CB 3.94Å; F69-A100 VanDerWaalsContact CE1-O 3.29Å; F69-A100 WeakPolarHBondContact CE1-O 3.34Å; F69-A100 HydrophobicContact CE2-CB 3.53Å; F69-A100 HydrophobicContact CG-CB 3.87Å; F69-A100 VanDerWaalsContact CZ-C 3.44Å; F69-A100 HydrophobicContact CZ-CB 3.7Å; F69-R101 HydrophobicContact CE2-CG 4.29Å; F69-R101 HydrophobicContact CZ-CG 3.96Å
70	D	98.7	Very high	98.1	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.064	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	122.7	173	-177.1	-7.3	0	0	0	108.8	R54 L56 D72 V73 G74	R54-D70 IonicContact CZ-OD1 2.84Å; R54-D70 IonicContact CZ-OD2 3.23Å; R54-D70 IonicContact NE-OD1 2.65Å; R54-D70 PolarHBondContact NE-OD1 3.33Å; R54-D70 IonicContact NE-OD2 2.81Å; R54-D70 PolarHBondContact NE-OD2 3.3Å; R54-D70 IonicContact NH2-OD1 2.79Å; R54-D70 IonicContact NH2-OD2 3.85Å; R54-D70 PolarHBondContact NH2-OD2 2.97Å; L56-D70 HydrophobicContact CD2-CB 3.68Å; L56-D70 WeakPolarHBondContact CD2-OD1 3.32Å; D70-D72 PolarHBondContact O-N 2.97Å; D70-D72 PolarHBondContact OD1-N 2.83Å; D70-D72 VanDerWaalsContact OD1-N 3.09Å; D70-V73 HydrophobicContact CB-CB 4.19Å; D70-V73 HydrophobicContact CB-CG2 3.95Å; D70-V73 CarbonylContact O-C 3.5Å; D70-V73 WeakPolarHBondContact O-CA 3.45Å; D70-V73 PolarHBondContact O-N 3.1Å; D70-G74 PolarHBondContact O-N 3.08Å
71	S	98.5	Very high	98	Very high	29 Å²	29	58.6 Å²	58.6	20%	0.203	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.2	-178.6	62.3	0	0	0	0	113.4	R54 F55 V73	R54-S71 WeakPolarHBondContact CA-OG 3.37Å; F55-S71 PolarHBondContact N-OG 2.76Å; F55-S71 PolarHBondContact O-N 2.85Å; S71-V73 PolarHBondContact O-N 2.96Å
72	D	98.2	Very high	98	Very high	84 Å²	84	58.7 Å²	58.7	45%	0.449	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-18	176.3	-74	7.3	0	0	0	111.5	R52 R54 D70	R52-D72 IonicContact NH2-OD2 2.68Å; R52-D72 PolarHBondContact NH2-OD2 3.36Å; R54-D72 IonicContact NE-OD2 2.72Å; D70-D72 PolarHBondContact O-N 2.97Å; D70-D72 PolarHBondContact OD1-N 2.83Å; D70-D72 VanDerWaalsContact OD1-N 3.09Å
73	V	98.3	Very high	98.2	Very high	81 Å²	81	55.9 Å²	55.9	49%	0.491	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-38.7	175.3	-177.9	0	0	0	0	111.5	D70 S71 E75 R77	D70-V73 HydrophobicContact CB-CB 4.19Å; D70-V73 HydrophobicContact CB-CG2 3.95Å; D70-V73 CarbonylContact O-C 3.5Å; D70-V73 WeakPolarHBondContact O-CA 3.45Å; D70-V73 PolarHBondContact O-N 3.1Å; S71-V73 PolarHBondContact O-N 2.96Å; V73-E75 HydrophobicContact CG1-CG 4.09Å; V73-R77 HydrophobicContact CG1-CG 4.45Å
74	G	98.1	Very high	98.3	Very high	13 Å²	13	52.7 Å²	52.7	13%	0.134	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	13.8	176	0	0	0	0	0	115.5	D70 L97 R101	D70-G74 PolarHBondContact O-N 3.08Å; G74-L97 WeakPolarHBondContact O-CD1 3.26Å; G74-R101 PolarHBondContact O-NE 3.37Å; G74-R101 PolarHBondContact O-NH2 2.83Å
75	E	98.4	Very high	98.3	Very high	57 Å²	57	52 Å²	52	27%	0.266	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	166.7	175.8	66.2	-177.2	-169.6	0	0	112.8	V73 R77 L97	V73-E75 HydrophobicContact CG1-CG 4.09Å; E75-R77 IonicContact OE1-CZ 3.77Å; E75-R77 IonicContact OE1-NE 3.63Å; E75-R77 PolarHBondContact OE1-NE 2.85Å; E75-R77 IonicContact OE1-NH2 3.48Å; E75-R77 PolarHBondContact OE1-NH2 2.82Å; E75-L97 HydrophobicContact CB-CD1 3.94Å
76	F	98.6	Very high	98.2	Very high	5 Å²	5	53.9 Å²	53.9	2%	0.022	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	136	174	-67.4	-93	0	0	0	110.4	Y59 V67 R68 F69 A87 W90 N91 I96 A100	Y59-F76 HydrophobicContact CE2-CE1 4.24Å; V67-F76 HydrophobicContact CG2-CB 4.21Å; V67-F76 HydrophobicContact CG2-CD1 4.3Å; R68-F76 CarbonylContact O-C 3.52Å; R68-F76 WeakPolarHBondContact O-CA 3.46Å; F69-F76 HydrophobicContact CB-CD1 3.62Å; F69-F76 HydrophobicContact CB-CD2 4.42Å; F69-F76 HydrophobicContact CB-CE1 3.52Å; F69-F76 HydrophobicContact CB-CE2 4.3Å; F69-F76 HydrophobicContact CB-CG 4.11Å; F69-F76 HydrophobicContact CB-CZ 3.87Å; F69-F76 HydrophobicContact CD2-CD2 4Å; F69-F76 AromaticContact CD2-CE2 3.94Å; F69-F76 HydrophobicContact CD2-CE2 3.94Å; F69-F76 HydrophobicContact CD2-CG 4.37Å; F69-F76 HydrophobicContact CD2-CZ 4.28Å; F69-F76 HydrophobicContact CG-CE1 4.47Å; F69-F76 HydrophobicContact CG-CE2 4.48Å; F69-F76 HydrophobicContact CG-CZ 4.37Å; F76-A87 HydrophobicContact CB-CB 4.43Å; F76-W90 HydrophobicContact CB-CE3 4.42Å; F76-W90 HydrophobicContact CD1-CD2 4.4Å; F76-W90 AromaticContact CD1-CE3 3.33Å; F76-W90 HydrophobicContact CD1-CE3 3.33Å; F76-W90 AromaticContact CD1-CZ3 3.78Å; F76-W90 HydrophobicContact CD1-CZ3 3.78Å; F76-W90 HydrophobicContact CD2-CB 3.78Å; F76-W90 HydrophobicContact CD2-CE3 4.41Å; F76-W90 HydrophobicContact CE1-CD2 4.39Å; F76-W90 AromaticContact CE1-CE3 3.5Å; F76-W90 HydrophobicContact CE1-CE3 3.5Å; F76-W90 VanDerWaalsContact CE1-CE3 3.5Å; F76-W90 AromaticContact CE1-CZ3 3.82Å; F76-W90 HydrophobicContact CE1-CZ3 3.82Å; F76-W90 HydrophobicContact CE2-CB 4.07Å; F76-W90 HydrophobicContact CG-CB 4.13Å; F76-W90 AromaticContact CG-CE3 3.82Å; F76-W90 HydrophobicContact CG-CE3 3.82Å; F76-W90 HydrophobicContact CZ-CE3 4.15Å; F76-N91 WeakPolarHBondContact CB-OD1 3.35Å; F76-N91 PolarHBondContact N-OD1 2.83Å; F76-N91 PolarHBondContact O-ND2 3.27Å; F76-I96 HydrophobicContact CE2-CG2 3.98Å; F76-I96 HydrophobicContact CZ-CG2 4.29Å; F76-A100 HydrophobicContact CE2-CB 4.14Å; F76-A100 HydrophobicContact CZ-CB 4.2Å
77	R	98.7	Very high	98.3	Very high	143 Å²	143	54 Å²	54	54%	0.54	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.8	174	-69.4	-65.3	-174	114.1	-3.7	109.7	V67 R68 V73 E75 V79	V67-R77 WeakPolarHBondContact CA-O 3.3Å; R68-R77 PolarHBondContact N-O 3.13Å; R68-R77 PolarHBondContact O-N 2.9Å; V73-R77 HydrophobicContact CG1-CG 4.45Å; E75-R77 IonicContact OE1-CZ 3.77Å; E75-R77 IonicContact OE1-NE 3.63Å; E75-R77 PolarHBondContact OE1-NE 2.85Å; E75-R77 IonicContact OE1-NH2 3.48Å; E75-R77 PolarHBondContact OE1-NH2 2.82Å; R77-V79 PolarHBondContact O-N 2.85Å
78	A	98.3	Very high	98.2	Very high	44 Å²	44	59.9 Å²	59.9	36%	0.364	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	125.3	167.6	0	0	0	0	0	108.9	R84 A87	A78-R84 HydrophobicContact CB-CB 4.28Å; A78-A87 HydrophobicContact CB-CB 4.28Å
79	V	98.3	Very high	98.2	Very high	60 Å²	60	62.5 Å²	62.5	36%	0.364	32%	0.318	S	S	.	.	S	Bend	trans	-87.9	-33.6	172.1	178.4	0	0	0	0	109.4	E65 S66 R68 R77	E65-V79 HydrophobicContact CB-CG1 4.24Å; E65-V79 HydrophobicContact CG-CB 4.25Å; E65-V79 HydrophobicContact CG-CG1 4.3Å; E65-V79 HydrophobicContact CG-CG2 3.99Å; E65-V79 WeakPolarHBondContact O-CB 3.34Å; E65-V79 WeakPolarHBondContact O-CG1 3.49Å; S66-V79 PolarHBondContact O-N 2.82Å; R68-V79 HydrophobicContact CB-CG2 3.92Å; R77-V79 PolarHBondContact O-N 2.85Å
80	T	98.1	Very high	98.2	Very high	38 Å²	38	64.5 Å²	64.5	23%	0.233	33%	0.326	C	S	.	.	S	Bend	trans	-133.4	168.8	170.3	72.8	0	0	0	0	111.1	E64 E65 S66 L82 G83	E64-T80 HydrophobicContact CG-CG2 3.84Å; E64-T80 WeakPolarHBondContact OE1-CB 3.04Å; E64-T80 WeakPolarHBondContact OE1-CG2 3.46Å; E64-T80 PolarHBondContact OE1-OG1 3.17Å; E65-T80 WeakPolarHBondContact O-CG2 3.31Å; S66-T80 PolarHBondContact O-N 2.91Å; T80-L82 PolarHBondContact O-N 2.81Å; T80-L82 VanDerWaalsContact O-N 3.14Å; T80-G83 PolarHBondContact O-N 2.94Å
81	E	97.7	Very high	98.2	Very high	130 Å²	130	66 Å²	66	61%	0.607	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-56.7	-30.2	-179.5	-67.7	-57	137.1	0	0	113.2	G83 R84	E81-G83 PolarHBondContact O-N 3.41Å; E81-R84 WeakPolarHBondContact O-CB 3.46Å; E81-R84 PolarHBondContact O-N 3.42Å; E81-R84 IonicContact OE1-CZ 3.9Å; E81-R84 IonicContact OE1-NH2 3.9Å; E81-R84 PolarHBondContact OE1-NH2 2.89Å; E81-R84 IonicContact OE2-CZ 2.83Å; E81-R84 VanDerWaalsContact OE2-CZ 3.23Å; E81-R84 IonicContact OE2-NE 3.4Å; E81-R84 PolarHBondContact OE2-NE 3.44Å; E81-R84 IonicContact OE2-NH2 2.77Å; E81-R84 PolarHBondContact OE2-NH2 2.79Å
82	L	97.2	Very high	98.2	Very high	92 Å²	92	68.6 Å²	68.6	48%	0.482	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-59.2	-33.7	177.6	-175.4	64.1	0	0	0	112.4	Y61 T80	Y61-L82 HydrophobicContact CD1-CD2 4.02Å; Y61-L82 HydrophobicContact CG-CD2 4.06Å; T80-L82 PolarHBondContact O-N 2.81Å; T80-L82 VanDerWaalsContact O-N 3.14Å
83	G	98.1	Very high	98.2	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-92.1	0.3	-178.2	0	0	0	0	0	115	S66 T80 E81 D86 A87	S66-G83 WeakPolarHBondContact O-CA 3.47Å; T80-G83 PolarHBondContact O-N 2.94Å; E81-G83 PolarHBondContact O-N 3.41Å; G83-D86 PolarHBondContact O-N 2.96Å; G83-A87 WeakPolarHBondContact O-CB 3.5Å; G83-A87 PolarHBondContact O-N 2.86Å
84	R	98.2	Very high	98.1	Very high	117 Å²	117	71.4 Å²	71.4	44%	0.442	35%	0.354	S	S	.	.	H	α-helix	trans	-56.7	-48.3	177.8	-178.3	-172.7	-62.8	-88.3	-0.7	112.6	A78 E81 D86 A87 E88	A78-R84 HydrophobicContact CB-CB 4.28Å; E81-R84 WeakPolarHBondContact O-CB 3.46Å; E81-R84 PolarHBondContact O-N 3.42Å; E81-R84 IonicContact OE1-CZ 3.9Å; E81-R84 IonicContact OE1-NH2 3.9Å; E81-R84 PolarHBondContact OE1-NH2 2.89Å; E81-R84 IonicContact OE2-CZ 2.83Å; E81-R84 VanDerWaalsContact OE2-CZ 3.23Å; E81-R84 IonicContact OE2-NE 3.4Å; E81-R84 PolarHBondContact OE2-NE 3.44Å; E81-R84 IonicContact OE2-NH2 2.77Å; E81-R84 PolarHBondContact OE2-NH2 2.79Å; R84-D86 VanDerWaalsContact C-N 3.33Å; R84-D86 PolarHBondContact O-N 2.87Å; R84-A87 PolarHBondContact O-N 2.92Å; R84-E88 WeakPolarHBondContact CG-OE1 3.48Å; R84-E88 WeakPolarHBondContact O-CG 3.2Å; R84-E88 PolarHBondContact O-N 2.92Å; R84-E88 VanDerWaalsContact O-N 3.12Å
85	P	98.1	Very high	98.1	Very high	80 Å²	80	76 Å²	76	52%	0.519	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-40	179.3	-21.1	34.2	0	0	0	112.5	Y89	P85-Y89 VanDerWaalsContact O-CB 3.24Å; P85-Y89 WeakPolarHBondContact O-CB 3.49Å; P85-Y89 PolarHBondContact O-N 3.24Å
86	D	97.6	Very high	98	Very high	62 Å²	62	75.8 Å²	75.8	33%	0.332	38%	0.376	S	S	.	.	H	α-helix	trans	-67	-43.5	-179.9	-67	-29.6	0	0	0	111.4	V67 G83 R84 Y89 W90	V67-D86 HydrophobicContact CG1-CB 4.09Å; V67-D86 HydrophobicContact CG2-CB 4.49Å; G83-D86 PolarHBondContact O-N 2.96Å; R84-D86 VanDerWaalsContact C-N 3.33Å; R84-D86 PolarHBondContact O-N 2.87Å; D86-Y89 PolarHBondContact O-N 2.7Å; D86-W90 HydrophobicContact CB-CD2 4.3Å; D86-W90 HydrophobicContact CB-CE3 4.22Å; D86-W90 HydrophobicContact CB-CH2 4.18Å; D86-W90 HydrophobicContact CB-CZ2 4.21Å; D86-W90 HydrophobicContact CB-CZ3 4.19Å; D86-W90 VanDerWaalsContact O-CB 3.32Å; D86-W90 WeakPolarHBondContact O-CB 3.42Å; D86-W90 VanDerWaalsContact O-CG 3.23Å; D86-W90 PolarHBondContact O-N 2.73Å
87	A	98.4	Very high	98	Very high	8 Å²	8	76.3 Å²	76.3	7%	0.066	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-46.2	178	0	0	0	0	0	111.8	V67 F76 A78 G83 R84 N91	V67-A87 HydrophobicContact CG2-CB 4Å; F76-A87 HydrophobicContact CB-CB 4.43Å; A78-A87 HydrophobicContact CB-CB 4.28Å; G83-A87 WeakPolarHBondContact O-CB 3.5Å; G83-A87 PolarHBondContact O-N 2.86Å; R84-A87 PolarHBondContact O-N 2.92Å; A87-N91 VanDerWaalsContact O-CB 3.24Å; A87-N91 WeakPolarHBondContact O-CB 3.44Å; A87-N91 PolarHBondContact O-N 2.86Å; A87-N91 PolarHBondContact O-ND2 2.9Å; A87-N91 VanDerWaalsContact O-ND2 3.09Å
88	E	97.9	Very high	97.9	Very high	123 Å²	123	73.7 Å²	73.7	58%	0.575	37%	0.373	S	S	*	.	H	α-helix	trans	-62.3	-46.7	176.6	-71.2	173.3	-169.1	0	0	111.3	R84 S92	R84-E88 WeakPolarHBondContact CG-OE1 3.48Å; R84-E88 WeakPolarHBondContact O-CG 3.2Å; R84-E88 PolarHBondContact O-N 2.92Å; R84-E88 VanDerWaalsContact O-N 3.12Å; E88-S92 PolarHBondContact O-N 3.04Å
89	Y	98.2	Very high	97.9	Very high	134 Å²	134	78.5 Å²	78.5	53%	0.525	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-51.9	179.9	179.4	-110.6	0	0	0	112	P85 D86 N91 S92 Q93	P85-Y89 VanDerWaalsContact O-CB 3.24Å; P85-Y89 WeakPolarHBondContact O-CB 3.49Å; P85-Y89 PolarHBondContact O-N 3.24Å; D86-Y89 PolarHBondContact O-N 2.7Å; Y89-N91 PolarHBondContact O-N 3.47Å; Y89-S92 WeakPolarHBondContact O-CB 3.32Å; Y89-S92 PolarHBondContact O-N 2.93Å; Y89-S92 VanDerWaalsContact O-N 3.13Å; Y89-S92 PolarHBondContact O-OG 3.32Å; Y89-Q93 WeakPolarHBondContact O-CG 3.01Å; Y89-Q93 PolarHBondContact O-N 3.08Å
90	W	98.3	Very high	97.9	Very high	42 Å²	42	76.1 Å²	76.1	16%	0.159	37%	0.374	C	S	.	.	H	α-helix	trans	-67.4	-34.6	-177.6	-64.3	-22.8	0	0	0	113.2	Y59 V67 F76 D86 S92 Q93 I96	Y59-W90 HydrophobicContact CD1-CH2 4.09Å; Y59-W90 AromaticContact CD2-CH2 3.76Å; Y59-W90 HydrophobicContact CD2-CH2 3.76Å; Y59-W90 AromaticContact CD2-CZ3 3.67Å; Y59-W90 HydrophobicContact CD2-CZ3 3.67Å; Y59-W90 AromaticContact CE1-CH2 3.95Å; Y59-W90 HydrophobicContact CE1-CH2 3.95Å; Y59-W90 AromaticContact CE2-CH2 3.66Å; Y59-W90 HydrophobicContact CE2-CH2 3.66Å; Y59-W90 AromaticContact CE2-CZ3 3.57Å; Y59-W90 HydrophobicContact CE2-CZ3 3.57Å; Y59-W90 AromaticContact CG-CH2 3.96Å; Y59-W90 HydrophobicContact CG-CH2 3.96Å; Y59-W90 HydrophobicContact CG-CZ3 4.29Å; Y59-W90 AromaticContact CZ-CH2 3.73Å; V67-W90 HydrophobicContact CB-CZ3 4.37Å; V67-W90 HydrophobicContact CG1-CE3 4.42Å; V67-W90 HydrophobicContact CG1-CH2 3.87Å; V67-W90 HydrophobicContact CG1-CZ3 3.47Å; V67-W90 VanDerWaalsContact CG1-CZ3 3.47Å; V67-W90 HydrophobicContact CG2-CE3 4.14Å; V67-W90 HydrophobicContact CG2-CZ3 3.92Å; F76-W90 HydrophobicContact CB-CE3 4.42Å; F76-W90 HydrophobicContact CD1-CD2 4.4Å; F76-W90 AromaticContact CD1-CE3 3.33Å; F76-W90 HydrophobicContact CD1-CE3 3.33Å; F76-W90 AromaticContact CD1-CZ3 3.78Å; F76-W90 HydrophobicContact CD1-CZ3 3.78Å; F76-W90 HydrophobicContact CD2-CB 3.78Å; F76-W90 HydrophobicContact CD2-CE3 4.41Å; F76-W90 HydrophobicContact CE1-CD2 4.39Å; F76-W90 AromaticContact CE1-CE3 3.5Å; F76-W90 HydrophobicContact CE1-CE3 3.5Å; F76-W90 VanDerWaalsContact CE1-CE3 3.5Å; F76-W90 AromaticContact CE1-CZ3 3.82Å; F76-W90 HydrophobicContact CE1-CZ3 3.82Å; F76-W90 HydrophobicContact CE2-CB 4.07Å; F76-W90 HydrophobicContact CG-CB 4.13Å; F76-W90 AromaticContact CG-CE3 3.82Å; F76-W90 HydrophobicContact CG-CE3 3.82Å; F76-W90 HydrophobicContact CZ-CE3 4.15Å; D86-W90 HydrophobicContact CB-CD2 4.3Å; D86-W90 HydrophobicContact CB-CE3 4.22Å; D86-W90 HydrophobicContact CB-CH2 4.18Å; D86-W90 HydrophobicContact CB-CZ2 4.21Å; D86-W90 HydrophobicContact CB-CZ3 4.19Å; D86-W90 VanDerWaalsContact O-CB 3.32Å; D86-W90 WeakPolarHBondContact O-CB 3.42Å; D86-W90 VanDerWaalsContact O-CG 3.23Å; D86-W90 PolarHBondContact O-N 2.73Å; W90-S92 VanDerWaalsContact C-N 3.26Å; W90-S92 PolarHBondContact O-N 2.96Å; W90-Q93 PolarHBondContact O-N 3.49Å; W90-I96 HydrophobicContact CB-CG2 4.37Å
91	N	98.5	Very high	97.9	Very high	43 Å²	43	79.2 Å²	79.2	23%	0.23	38%	0.382	C	S	.	.	H	α-helix	trans	-70.2	-23.1	174.4	-70	-22.9	0	0	0	113	F76 A87 Y89 Q93	F76-N91 WeakPolarHBondContact CB-OD1 3.35Å; F76-N91 PolarHBondContact N-OD1 2.83Å; F76-N91 PolarHBondContact O-ND2 3.27Å; A87-N91 VanDerWaalsContact O-CB 3.24Å; A87-N91 WeakPolarHBondContact O-CB 3.44Å; A87-N91 PolarHBondContact O-N 2.86Å; A87-N91 PolarHBondContact O-ND2 2.9Å; A87-N91 VanDerWaalsContact O-ND2 3.09Å; Y89-N91 PolarHBondContact O-N 3.47Å; N91-Q93 VanDerWaalsContact C-N 3.31Å
92	S	98.1	Very high	98	Very high	84 Å²	84	75 Å²	75	59%	0.587	37%	0.369	S	S	*	.	H	α-helix	trans	-75.6	-20.7	174	78.6	0	0	0	0	113.2	E88 Y89 W90 K94	E88-S92 PolarHBondContact O-N 3.04Å; Y89-S92 WeakPolarHBondContact O-CB 3.32Å; Y89-S92 PolarHBondContact O-N 2.93Å; Y89-S92 VanDerWaalsContact O-N 3.13Å; Y89-S92 PolarHBondContact O-OG 3.32Å; W90-S92 VanDerWaalsContact C-N 3.26Å; W90-S92 PolarHBondContact O-N 2.96Å; S92-K94 PolarHBondContact O-N 3.45Å
93	Q	98.2	Very high	98	Very high	65 Å²	65	71 Å²	71	30%	0.304	35%	0.349	S	S	.	.			trans	-92.1	97.9	179.6	-60.4	-66.4	-25.2	0	0	109.7	Y89 W90 N91 D95 I96 L97	Y89-Q93 WeakPolarHBondContact O-CG 3.01Å; Y89-Q93 PolarHBondContact O-N 3.08Å; W90-Q93 PolarHBondContact O-N 3.49Å; N91-Q93 VanDerWaalsContact C-N 3.31Å; Q93-D95 VanDerWaalsContact C-N 3.29Å; Q93-D95 PolarHBondContact O-N 3.05Å; Q93-I96 HydrophobicContact CB-CB 4Å; Q93-I96 HydrophobicContact CB-CD1 3.64Å; Q93-I96 HydrophobicContact CB-CG1 3.77Å; Q93-I96 HydrophobicContact CG-CD1 3.92Å; Q93-I96 PolarHBondContact O-N 2.98Å; Q93-L97 PolarHBondContact O-N 2.84Å; Q93-L97 VanDerWaalsContact O-N 3.09Å
94	K	97.2	Very high	98.1	Very high	159 Å²	159	71.9 Å²	71.9	69%	0.691	36%	0.355	S	S	*	.	H	α-helix	trans	-59.3	-38.6	-173.8	-175.9	176.5	179.2	-179.8	0	113	S92 L97 E98	S92-K94 PolarHBondContact O-N 3.45Å; K94-L97 PolarHBondContact O-N 2.91Å; K94-E98 HydrophobicContact CG-CG 4.17Å; K94-E98 WeakPolarHBondContact O-CB 3.18Å; K94-E98 VanDerWaalsContact O-CG 3.29Å; K94-E98 WeakPolarHBondContact O-CG 3.48Å; K94-E98 PolarHBondContact O-N 2.02Å
95	D	97.5	Very high	98.1	Very high	109 Å²	109	70.7 Å²	70.7	58%	0.583	36%	0.357	S	S	*	.	H	α-helix	trans	-61.4	-44.8	177.2	59.1	-27.1	0	0	0	112.3	Q93 Q99	Q93-D95 VanDerWaalsContact C-N 3.29Å; Q93-D95 PolarHBondContact O-N 3.05Å; D95-Q99 WeakPolarHBondContact O-CB 3.4Å; D95-Q99 PolarHBondContact O-N 2.88Å
96	I	97.2	Very high	98.1	Very high	53 Å²	53	71.2 Å²	71.2	27%	0.272	36%	0.359	S	S	.	.	H	α-helix	trans	-61.9	-46.9	175.9	-61	-177	0	0	0	110.5	F76 W90 Q93 Q99 A100	F76-I96 HydrophobicContact CE2-CG2 3.98Å; F76-I96 HydrophobicContact CZ-CG2 4.29Å; W90-I96 HydrophobicContact CB-CG2 4.37Å; Q93-I96 HydrophobicContact CB-CB 4Å; Q93-I96 HydrophobicContact CB-CD1 3.64Å; Q93-I96 HydrophobicContact CB-CG1 3.77Å; Q93-I96 HydrophobicContact CG-CD1 3.92Å; Q93-I96 PolarHBondContact O-N 2.98Å; I96-Q99 PolarHBondContact O-N 3.09Å; I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 2.98Å
97	L	97.7	Very high	98.1	Very high	16 Å²	16	72.5 Å²	72.5	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-65.3	-43.7	-177.6	-173.4	60.8	0	0	0	112.4	F69 G74 E75 Q93 K94 A100 R101	F69-L97 HydrophobicContact CE2-CD1 4.07Å; G74-L97 WeakPolarHBondContact O-CD1 3.26Å; E75-L97 HydrophobicContact CB-CD1 3.94Å; Q93-L97 PolarHBondContact O-N 2.84Å; Q93-L97 VanDerWaalsContact O-N 3.09Å; K94-L97 PolarHBondContact O-N 2.91Å; L97-A100 PolarHBondContact O-N 3.04Å; L97-R101 VanDerWaalsContact O-CG 3.27Å; L97-R101 WeakPolarHBondContact O-CG 3.43Å; L97-R101 PolarHBondContact O-N 2.8Å
98	E	98.1	Very high	98.1	Very high	88 Å²	88	72.1 Å²	72.1	41%	0.411	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-37.3	176.4	-68.5	-55.7	131.2	0	0	112	K94 R101 A102	K94-E98 HydrophobicContact CG-CG 4.17Å; K94-E98 WeakPolarHBondContact O-CB 3.18Å; K94-E98 VanDerWaalsContact O-CG 3.29Å; K94-E98 WeakPolarHBondContact O-CG 3.48Å; K94-E98 PolarHBondContact O-N 2.02Å; E98-R101 PolarHBondContact O-N 2.91Å; E98-R101 IonicContact OE1-CZ 3.78Å; E98-R101 IonicContact OE1-NH1 3.2Å; E98-R101 PolarHBondContact OE1-NH1 2.84Å; E98-A102 WeakPolarHBondContact O-CB 3.25Å; E98-A102 PolarHBondContact O-N 2.84Å
99	Q	98	Very high	98.2	Very high	145 Å²	145	69.9 Å²	69.9	68%	0.678	34%	0.343	S	S	*	.	H	α-helix	trans	-62.1	-43.4	173.3	-175.4	178.6	0.9	0	0	111.7	D95 I96 A102 A103	D95-Q99 WeakPolarHBondContact O-CB 3.4Å; D95-Q99 PolarHBondContact O-N 2.88Å; I96-Q99 PolarHBondContact O-N 3.09Å; Q99-A102 PolarHBondContact O-N 2.74Å; Q99-A103 PolarHBondContact O-N 2.99Å; Q99-A103 VanDerWaalsContact O-N 3.15Å
100	A	98	Very high	98.2	Very high	10 Å²	10	68.9 Å²	68.9	8%	0.083	34%	0.343	C	S	.	.	H	α-helix	trans	-65	-40.1	177.2	0	0	0	0	0	112.1	F69 F76 I96 L97 A102 A103	F69-A100 HydrophobicContact CD1-CB 4.01Å; F69-A100 HydrophobicContact CD2-CB 3.62Å; F69-A100 HydrophobicContact CE1-CB 3.94Å; F69-A100 VanDerWaalsContact CE1-O 3.29Å; F69-A100 WeakPolarHBondContact CE1-O 3.34Å; F69-A100 HydrophobicContact CE2-CB 3.53Å; F69-A100 HydrophobicContact CG-CB 3.87Å; F69-A100 VanDerWaalsContact CZ-C 3.44Å; F69-A100 HydrophobicContact CZ-CB 3.7Å; F76-A100 HydrophobicContact CE2-CB 4.14Å; F76-A100 HydrophobicContact CZ-CB 4.2Å; I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 2.98Å; L97-A100 PolarHBondContact O-N 3.04Å; A100-A102 VanDerWaalsContact C-N 3.35Å; A100-A102 PolarHBondContact O-N 2.77Å; A100-A103 VanDerWaalsContact O-CB 3.28Å; A100-A103 WeakPolarHBondContact O-CB 3.32Å; A100-A103 PolarHBondContact O-N 3.27Å
101	R	98.3	Very high	98.2	Very high	104 Å²	104	69.7 Å²	69.7	39%	0.392	35%	0.35	S	S	.	.	H	α-helix	trans	-61.9	-40.6	173.4	-72.4	166.8	177.3	174.9	-2.6	112.3	F69 G74 L97 E98 A103	F69-R101 HydrophobicContact CE2-CG 4.29Å; F69-R101 HydrophobicContact CZ-CG 3.96Å; G74-R101 PolarHBondContact O-NE 3.37Å; G74-R101 PolarHBondContact O-NH2 2.83Å; L97-R101 VanDerWaalsContact O-CG 3.27Å; L97-R101 WeakPolarHBondContact O-CG 3.43Å; L97-R101 PolarHBondContact O-N 2.8Å; E98-R101 PolarHBondContact O-N 2.91Å; E98-R101 IonicContact OE1-CZ 3.78Å; E98-R101 IonicContact OE1-NH1 3.2Å; E98-R101 PolarHBondContact OE1-NH1 2.84Å; R101-A103 VanDerWaalsContact C-N 3.28Å; R101-A103 PolarHBondContact O-N 3.38Å
102	A	98.5	Very high	98.2	Very high	40 Å²	40	69.3 Å²	69.3	33%	0.331	35%	0.346	S	S	.	.	H	α-helix	trans	-73.7	-14.6	178.9	0	0	0	0	0	114	E98 Q99 A100 V104 D105 T106	E98-A102 WeakPolarHBondContact O-CB 3.25Å; E98-A102 PolarHBondContact O-N 2.84Å; Q99-A102 PolarHBondContact O-N 2.74Å; A100-A102 VanDerWaalsContact C-N 3.35Å; A100-A102 PolarHBondContact O-N 2.77Å; A102-V104 PolarHBondContact O-N 3.45Å; A102-V104 VanDerWaalsContact O-N 3.16Å; A102-D105 PolarHBondContact O-N 3.43Å; A102-T106 HydrophobicContact CB-CG2 4.21Å; A102-T106 PolarHBondContact O-N 3.19Å; A102-T106 PolarHBondContact O-OG1 3.19Å; A102-T106 VanDerWaalsContact O-OG1 3.06Å
103	A	98.6	Very high	98.1	Very high	9 Å²	9	67.6 Å²	67.6	7%	0.074	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-23.2	-175.3	0	0	0	0	0	113.9	F55 Q99 A100 R101 D105 Y107 C108	F55-A103 HydrophobicContact CD1-CB 3.52Å; F55-A103 HydrophobicContact CD2-CB 4.27Å; F55-A103 HydrophobicContact CE1-CB 3.5Å; F55-A103 VanDerWaalsContact CE1-CB 3.5Å; F55-A103 HydrophobicContact CE2-CB 4.24Å; F55-A103 HydrophobicContact CG-CB 3.91Å; F55-A103 HydrophobicContact CZ-CB 3.88Å; Q99-A103 PolarHBondContact O-N 2.99Å; Q99-A103 VanDerWaalsContact O-N 3.15Å; A100-A103 VanDerWaalsContact O-CB 3.28Å; A100-A103 WeakPolarHBondContact O-CB 3.32Å; A100-A103 PolarHBondContact O-N 3.27Å; R101-A103 VanDerWaalsContact C-N 3.28Å; R101-A103 PolarHBondContact O-N 3.38Å; A103-D105 PolarHBondContact O-N 3.02Å; A103-Y107 WeakPolarHBondContact O-CA 3.25Å; A103-Y107 VanDerWaalsContact O-CB 3.31Å; A103-Y107 WeakPolarHBondContact O-CB 3.42Å; A103-Y107 PolarHBondContact O-N 2.84Å; A103-Y107 VanDerWaalsContact O-N 3.07Å; A103-C108 PolarHBondContact O-N 3.43Å
104	V	98.6	Very high	98.1	Very high	18 Å²	18	68.5 Å²	68.5	11%	0.109	35%	0.351	C	S	.	.	I	π-helix	trans	-56.2	-41.8	172.7	-176	0	0	0	0	110.8	V53 F55 A102 C108 R109	V53-V104 HydrophobicContact CB-CG1 3.65Å; V53-V104 HydrophobicContact CG1-CG1 3.83Å; F55-V104 HydrophobicContact CB-CG2 3.99Å; A102-V104 PolarHBondContact O-N 3.45Å; A102-V104 VanDerWaalsContact O-N 3.16Å; V104-C108 WeakPolarHBondContact O-CB 3.36Å; V104-R109 WeakPolarHBondContact O-CG 3.49Å; V104-R109 PolarHBondContact O-N 2.73Å
105	D	98.5	Very high	98.1	Very high	92 Å²	92	63.2 Å²	63.2	49%	0.492	33%	0.332	S	S	.	.	I	π-helix	trans	-90.9	-53.8	179.4	-72.1	-61.1	0	0	0	112.3	A102 A103 Y107 R109 H110	A102-D105 PolarHBondContact O-N 3.43Å; A103-D105 PolarHBondContact O-N 3.02Å; D105-Y107 VanDerWaalsContact C-N 3.31Å; D105-Y107 PolarHBondContact O-N 3.24Å; D105-R109 VanDerWaalsContact CG-NH1 3.3Å; D105-R109 WeakPolarHBondContact OD1-CD 3.33Å; D105-R109 IonicContact OD1-CZ 3.96Å; D105-R109 IonicContact OD1-NE 3.59Å; D105-R109 IonicContact OD1-NH1 2.92Å; D105-R109 PolarHBondContact OD1-NH1 2.97Å; D105-R109 IonicContact OD2-NH1 3.85Å; D105-R109 PolarHBondContact OD2-NH1 3.24Å; D105-H110 PolarHBondContact O-N 3.42Å; D105-H110 VanDerWaalsContact O-N 3.11Å
106	T	98.3	Very high	98.1	Very high	92 Å²	92	61.1 Å²	61.1	56%	0.564	32%	0.319	S	S	*	.	I	π-helix	trans	-71.3	-27.3	-169.3	61.8	0	0	0	0	113	A102 H110	A102-T106 HydrophobicContact CB-CG2 4.21Å; A102-T106 PolarHBondContact O-N 3.19Å; A102-T106 PolarHBondContact O-OG1 3.19Å; A102-T106 VanDerWaalsContact O-OG1 3.06Å; T106-H110 VanDerWaalsContact O-CB 3.31Å; T106-H110 WeakPolarHBondContact O-CB 3.5Å
107	Y	98.4	Very high	98.1	Very high	88 Å²	88	63 Å²	63	35%	0.345	34%	0.337	S	S	.	.	I	π-helix	trans	-110.2	-58	179.4	-179.7	-105.5	0	0	0	111.1	R42 C44 F55 A103 D105 N111	R42-Y107 HydrophobicContact CB-CE1 4.01Å; C44-Y107 VanDerWaalsContact SG-CD1 3.56Å; F55-Y107 HydrophobicContact CD2-CD1 4.25Å; F55-Y107 AromaticContact CE2-CD1 3.86Å; F55-Y107 HydrophobicContact CE2-CD1 3.86Å; F55-Y107 HydrophobicContact CE2-CE1 4.13Å; A103-Y107 WeakPolarHBondContact O-CA 3.25Å; A103-Y107 VanDerWaalsContact O-CB 3.31Å; A103-Y107 WeakPolarHBondContact O-CB 3.42Å; A103-Y107 PolarHBondContact O-N 2.84Å; A103-Y107 VanDerWaalsContact O-N 3.07Å; D105-Y107 VanDerWaalsContact C-N 3.31Å; D105-Y107 PolarHBondContact O-N 3.24Å; Y107-N111 VanDerWaalsContact CD2-ND2 3.25Å; Y107-N111 WeakPolarHBondContact CD2-ND2 3.44Å; Y107-N111 VanDerWaalsContact CE2-ND2 3.27Å; Y107-N111 WeakPolarHBondContact CE2-ND2 3.41Å; Y107-N111 WeakPolarHBondContact O-CB 3.48Å; Y107-N111 PolarHBondContact O-N 3.2Å; Y107-N111 PolarHBondContact O-ND2 3.5Å
108	C	98.7	Very high	98	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.357	C	S	.	.	I	π-helix	trans	-71.4	-58.7	-171.9	-62.1	0	0	0	0	113.3	C44 F46 V53 A103 V104 H110 N111 Y112	C44-C108 HydrophobicContact CB-CB 3.62Å; C44-C108 WeakPolarHBondContact CB-SG 3.3Å; C44-C108 WeakPolarHBondContact SG-CA 3.42Å; C44-C108 WeakPolarHBondContact SG-CB 3.26Å; C44-C108 CovalentContact SG-SG 2.04Å; C44-C108 PolarHBondContact SG-SG 2.73Å; F46-C108 HydrophobicContact CE1-CB 4.1Å; F46-C108 HydrophobicContact CZ-CB 4.08Å; F46-C108 WeakPolarHBondContact CZ-O 3.45Å; V53-C108 HydrophobicContact CG1-CB 3.51Å; A103-C108 PolarHBondContact O-N 3.43Å; V104-C108 WeakPolarHBondContact O-CB 3.36Å; C108-H110 PolarHBondContact O-N 3Å; C108-N111 PolarHBondContact O-N 3.08Å; C108-Y112 WeakPolarHBondContact O-CB 3.32Å; C108-Y112 PolarHBondContact O-N 2.97Å
109	R	98.5	Very high	97.9	Very high	77 Å²	77	64.8 Å²	64.8	29%	0.291	34%	0.344	S	S	.	.	I	π-helix	trans	-64	-40.8	-180	-69.9	-169	-177.9	97.1	1.1	112.1	T50 E51 V53 V104 D105 Y112 G113	T50-R109 PolarHBondContact O-NE 2.88Å; E51-R109 PolarHBondContact O-NH2 2.77Å; V53-R109 HydrophobicContact CG2-CG 3.98Å; V104-R109 WeakPolarHBondContact O-CG 3.49Å; V104-R109 PolarHBondContact O-N 2.73Å; D105-R109 VanDerWaalsContact CG-NH1 3.3Å; D105-R109 WeakPolarHBondContact OD1-CD 3.33Å; D105-R109 IonicContact OD1-CZ 3.96Å; D105-R109 IonicContact OD1-NE 3.59Å; D105-R109 IonicContact OD1-NH1 2.92Å; D105-R109 PolarHBondContact OD1-NH1 2.97Å; D105-R109 IonicContact OD2-NH1 3.85Å; D105-R109 PolarHBondContact OD2-NH1 3.24Å; R109-Y112 PolarHBondContact O-N 3.25Å; R109-G113 PolarHBondContact O-N 3.31Å; R109-G113 VanDerWaalsContact O-N 3.13Å
110	H	98.2	Very high	97.9	Very high	113 Å²	113	60.5 Å²	60.5	52%	0.523	33%	0.328	S	S	.	.	H	α-helix	trans	-54.7	-56.2	173.8	177.5	72.6	0	0	0	111.7	D105 T106 C108 Y112 G113 V114	D105-H110 PolarHBondContact O-N 3.42Å; D105-H110 VanDerWaalsContact O-N 3.11Å; T106-H110 VanDerWaalsContact O-CB 3.31Å; T106-H110 WeakPolarHBondContact O-CB 3.5Å; C108-H110 PolarHBondContact O-N 3Å; H110-Y112 PolarHBondContact O-N 3.02Å; H110-G113 PolarHBondContact O-N 3.34Å; H110-V114 WeakPolarHBondContact O-CG2 3.28Å; H110-V114 PolarHBondContact O-N 3Å; H110-V114 VanDerWaalsContact O-N 3.1Å
111	N	98.4	Very high	97.8	Very high	58 Å²	58	65 Å²	65	31%	0.31	35%	0.348	S	S	.	.	H	α-helix	trans	-66.2	-37.7	-177.4	-73.4	-33.2	0	0	0	112.3	Y107 C108 G113 V114 V115	Y107-N111 VanDerWaalsContact CD2-ND2 3.25Å; Y107-N111 WeakPolarHBondContact CD2-ND2 3.44Å; Y107-N111 VanDerWaalsContact CE2-ND2 3.27Å; Y107-N111 WeakPolarHBondContact CE2-ND2 3.41Å; Y107-N111 WeakPolarHBondContact O-CB 3.48Å; Y107-N111 PolarHBondContact O-N 3.2Å; Y107-N111 PolarHBondContact O-ND2 3.5Å; C108-N111 PolarHBondContact O-N 3.08Å; N111-G113 VanDerWaalsContact C-N 3.32Å; N111-G113 PolarHBondContact O-N 3.47Å; N111-V114 PolarHBondContact O-N 3.44Å; N111-V115 WeakPolarHBondContact O-CG2 3.08Å; N111-V115 PolarHBondContact O-N 2.91Å
112	Y	98.4	Very high	97.7	Very high	36 Å²	36	64.3 Å²	64.3	14%	0.141	35%	0.345	C	S	.	.	H	α-helix	trans	-51.8	-53.4	173.5	-174	-81	0	0	0	110.4	F46 T50 C108 R109 H110 V114 V115 E116 V120	F46-Y112 HydrophobicContact CB-CD2 4.42Å; F46-Y112 HydrophobicContact CB-CE2 4.23Å; F46-Y112 AromaticContact CD1-CD2 3.49Å; F46-Y112 HydrophobicContact CD1-CD2 3.49Å; F46-Y112 VanDerWaalsContact CD1-CD2 3.49Å; F46-Y112 HydrophobicContact CD1-CE2 4.07Å; F46-Y112 HydrophobicContact CD1-CG 4.2Å; F46-Y112 AromaticContact CD2-CD2 3.92Å; F46-Y112 HydrophobicContact CD2-CD2 3.92Å; F46-Y112 HydrophobicContact CD2-CE2 4.38Å; F46-Y112 AromaticContact CE1-CD2 3.58Å; F46-Y112 HydrophobicContact CE1-CD2 3.58Å; F46-Y112 AromaticContact CE1-CG 3.97Å; F46-Y112 HydrophobicContact CE1-CG 3.97Å; F46-Y112 AromaticContact CE2-CD2 3.98Å; F46-Y112 HydrophobicContact CE2-CD2 3.98Å; F46-Y112 AromaticContact CG-CD2 3.67Å; F46-Y112 HydrophobicContact CG-CD2 3.67Å; F46-Y112 AromaticContact CG-CE2 3.97Å; F46-Y112 HydrophobicContact CG-CE2 3.97Å; F46-Y112 AromaticContact CZ-CD2 3.82Å; F46-Y112 HydrophobicContact CZ-CD2 3.82Å; F46-Y112 HydrophobicContact CZ-CG 4.3Å; T50-Y112 HydrophobicContact CG2-CD1 3.33Å; T50-Y112 HydrophobicContact CG2-CD2 3.92Å; T50-Y112 HydrophobicContact CG2-CE1 3.68Å; T50-Y112 HydrophobicContact CG2-CE2 4.21Å; T50-Y112 HydrophobicContact CG2-CG 3.46Å; T50-Y112 VanDerWaalsContact CG2-CG 3.46Å; C108-Y112 WeakPolarHBondContact O-CB 3.32Å; C108-Y112 PolarHBondContact O-N 2.97Å; R109-Y112 PolarHBondContact O-N 3.25Å; H110-Y112 PolarHBondContact O-N 3.02Å; Y112-V114 VanDerWaalsContact C-N 3.33Å; Y112-V114 PolarHBondContact O-N 3.5Å; Y112-V115 PolarHBondContact O-N 3.28Å; Y112-E116 HydrophobicContact CD1-CB 4.42Å; Y112-E116 HydrophobicContact CD1-CG 4.38Å; Y112-E116 HydrophobicContact CE1-CB 4.37Å; Y112-E116 HydrophobicContact CE1-CG 3.84Å; Y112-E116 WeakPolarHBondContact O-CA 3.24Å; Y112-E116 VanDerWaalsContact O-CB 3.26Å; Y112-E116 WeakPolarHBondContact O-CB 3.4Å; Y112-E116 PolarHBondContact O-N 3.28Å; Y112-V120 HydrophobicContact CE2-CG2 3.8Å
113	G	97.6	Very high	97.7	Very high	48 Å²	48	67.7 Å²	67.7	50%	0.495	35%	0.349	S	S	.	.	H	α-helix	trans	-63	-35.4	179.8	0	0	0	0	0	113.8	R109 H110 N111	R109-G113 PolarHBondContact O-N 3.31Å; R109-G113 VanDerWaalsContact O-N 3.13Å; H110-G113 PolarHBondContact O-N 3.34Å; N111-G113 VanDerWaalsContact C-N 3.32Å; N111-G113 PolarHBondContact O-N 3.47Å
114	V	97.8	Very high	97.7	Very high	83 Å²	83	69.3 Å²	69.3	50%	0.503	36%	0.358	S	S	.	.	H	α-helix	trans	-65.6	-40	177.4	172.2	0	0	0	0	111.9	H110 N111 Y112	H110-V114 WeakPolarHBondContact O-CG2 3.28Å; H110-V114 PolarHBondContact O-N 3Å; H110-V114 VanDerWaalsContact O-N 3.1Å; N111-V114 PolarHBondContact O-N 3.44Å; Y112-V114 VanDerWaalsContact C-N 3.33Å; Y112-V114 PolarHBondContact O-N 3.5Å
115	V	97.2	Very high	97.7	Very high	48 Å²	48	74.6 Å²	74.6	29%	0.291	38%	0.381	S	S	.	.	H	α-helix	trans	-103.9	-3.9	-173.1	-50.5	0	0	0	0	114.7	N111 Y112 S117 F118 T119	N111-V115 WeakPolarHBondContact O-CG2 3.08Å; N111-V115 PolarHBondContact O-N 2.91Å; Y112-V115 PolarHBondContact O-N 3.28Å; V115-S117 VanDerWaalsContact C-N 3.28Å; V115-S117 PolarHBondContact O-N 3.44Å; V115-F118 HydrophobicContact CB-CE1 3.92Å; V115-F118 HydrophobicContact CB-CE2 3.97Å; V115-F118 HydrophobicContact CB-CZ 3.49Å; V115-F118 VanDerWaalsContact CB-CZ 3.49Å; V115-F118 HydrophobicContact CG1-CE1 4.17Å; V115-F118 HydrophobicContact CG1-CE2 4.29Å; V115-F118 HydrophobicContact CG1-CZ 3.55Å; V115-F118 PolarHBondContact O-N 3.49Å; V115-T119 HydrophobicContact CB-CG2 4.04Å; V115-T119 HydrophobicContact CG2-CG2 3.99Å; V115-T119 WeakPolarHBondContact O-CB 3.44Å; V115-T119 WeakPolarHBondContact O-CG2 3.26Å; V115-T119 PolarHBondContact O-N 2.95Å; V115-T119 VanDerWaalsContact O-N 3.09Å; V115-T119 PolarHBondContact O-OG1 2.87Å
116	E	97.5	Very high	97.7	Very high	66 Å²	66	70.7 Å²	70.7	31%	0.308	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-52.9	-44.9	-172	-169.5	-176.4	169.1	0	0	112.5	Y112 F118 T119 V120 Q121	Y112-E116 HydrophobicContact CD1-CB 4.42Å; Y112-E116 HydrophobicContact CD1-CG 4.38Å; Y112-E116 HydrophobicContact CE1-CB 4.37Å; Y112-E116 HydrophobicContact CE1-CG 3.84Å; Y112-E116 WeakPolarHBondContact O-CA 3.24Å; Y112-E116 VanDerWaalsContact O-CB 3.26Å; Y112-E116 WeakPolarHBondContact O-CB 3.4Å; Y112-E116 PolarHBondContact O-N 3.28Å; E116-F118 VanDerWaalsContact C-N 3.29Å; E116-F118 PolarHBondContact O-N 2.86Å; E116-T119 PolarHBondContact O-N 2.95Å; E116-V120 HydrophobicContact CG-CB 3.97Å; E116-V120 HydrophobicContact CG-CG2 4.25Å; E116-V120 PolarHBondContact O-N 3.39Å; E116-V120 VanDerWaalsContact O-N 3.12Å; E116-Q121 HydrophobicContact CG-CG 4.24Å; E116-Q121 PolarHBondContact O-N 3.27Å; E116-Q121 VanDerWaalsContact O-N 3.08Å; E116-Q121 PolarHBondContact OE1-NE2 2.85Å
117	S	95.9	Very high	97.7	Very high	92 Å²	92	73.2 Å²	73.2	64%	0.643	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-61.1	-32.8	-173.1	61.3	0	0	0	0	113.8	V115	V115-S117 VanDerWaalsContact C-N 3.28Å; V115-S117 PolarHBondContact O-N 3.44Å
118	F	95.8	Very high	97.7	Very high	117 Å²	117	70.2 Å²	70.2	51%	0.513	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-112.8	0.1	-177.8	64.2	-95.7	0	0	0	114.1	V115 E116 R122	V115-F118 HydrophobicContact CB-CE1 3.92Å; V115-F118 HydrophobicContact CB-CE2 3.97Å; V115-F118 HydrophobicContact CB-CZ 3.49Å; V115-F118 VanDerWaalsContact CB-CZ 3.49Å; V115-F118 HydrophobicContact CG1-CE1 4.17Å; V115-F118 HydrophobicContact CG1-CE2 4.29Å; V115-F118 HydrophobicContact CG1-CZ 3.55Å; V115-F118 PolarHBondContact O-N 3.49Å; E116-F118 VanDerWaalsContact C-N 3.29Å; E116-F118 PolarHBondContact O-N 2.86Å; F118-R122 WeakPolarHBondContact O-CB 3.5Å
119	T	97.2	Very high	97.6	Very high	24 Å²	24	73.1 Å²	73.1	15%	0.147	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-73.3	175.9	58.4	0	0	0	0	111.4	V115 E116 Q121 R122 W182	V115-T119 HydrophobicContact CB-CG2 4.04Å; V115-T119 HydrophobicContact CG2-CG2 3.99Å; V115-T119 WeakPolarHBondContact O-CB 3.44Å; V115-T119 WeakPolarHBondContact O-CG2 3.26Å; V115-T119 PolarHBondContact O-N 2.95Å; V115-T119 VanDerWaalsContact O-N 3.09Å; V115-T119 PolarHBondContact O-OG1 2.87Å; E116-T119 PolarHBondContact O-N 2.95Å; T119-Q121 PolarHBondContact O-N 3.38Å; T119-R122 VanDerWaalsContact O-CB 3.28Å; T119-R122 WeakPolarHBondContact O-CB 3.45Å; T119-R122 PolarHBondContact O-N 3.37Å; T119-W182 HydrophobicContact CG2-CH2 4.04Å; T119-W182 HydrophobicContact CG2-CZ3 4.08Å
120	V	96.9	Very high	97.6	Very high	56 Å²	56	70.4 Å²	70.4	34%	0.339	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-45.1	-176.5	179.6	0	0	0	0	111.5	Y112 E116 R122 R123	Y112-V120 HydrophobicContact CE2-CG2 3.8Å; E116-V120 HydrophobicContact CG-CB 3.97Å; E116-V120 HydrophobicContact CG-CG2 4.25Å; E116-V120 PolarHBondContact O-N 3.39Å; E116-V120 VanDerWaalsContact O-N 3.12Å; V120-R122 VanDerWaalsContact C-N 3.28Å; V120-R122 PolarHBondContact O-N 3.09Å; V120-R123 PolarHBondContact O-NH1 2.86Å
121	Q	96.1	Very high	97.4	Very high	105 Å²	105	69.4 Å²	69.4	49%	0.491	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-3.7	-178.2	-56.4	-58.9	-18.5	0	0	113.1	E116 T119 R123	E116-Q121 HydrophobicContact CG-CG 4.24Å; E116-Q121 PolarHBondContact O-N 3.27Å; E116-Q121 VanDerWaalsContact O-N 3.08Å; E116-Q121 PolarHBondContact OE1-NE2 2.85Å; T119-Q121 PolarHBondContact O-N 3.38Å; Q121-R123 PolarHBondContact O-N 3.25Å
122	R	97.6	Very high	97.2	Very high	88 Å²	88	68.5 Å²	68.5	33%	0.332	35%	0.354	S	S	.	.			trans	-62.1	128	179.6	-175.9	-179.8	177.9	82.6	-0.9	110	F118 T119 V120 V124 Y152	F118-R122 WeakPolarHBondContact O-CB 3.5Å; T119-R122 VanDerWaalsContact O-CB 3.28Å; T119-R122 WeakPolarHBondContact O-CB 3.45Å; T119-R122 PolarHBondContact O-N 3.37Å; V120-R122 VanDerWaalsContact C-N 3.28Å; V120-R122 PolarHBondContact O-N 3.09Å; R122-V124 HydrophobicContact CG-CG2 4.33Å; R122-Y152 HydrophobicContact CB-CD1 3.76Å; R122-Y152 HydrophobicContact CB-CE1 3.77Å; R122-Y152 HydrophobicContact CG-CD1 3.63Å; R122-Y152 HydrophobicContact CG-CE1 4.05Å; R122-Y152 HydrophobicContact CG-CG 4.29Å; R122-Y152 WeakPolarHBondContact O-CD1 3.39Å
123	R	97.9	Very high	96.8	Very high	112 Å²	112	69.8 Å²	69.8	42%	0.423	37%	0.369	S	S	.	.			trans	-134.7	123.8	174.5	-64.3	-64.1	179.8	-91.7	-2.5	108.5	V120 Q121 Y152	V120-R123 PolarHBondContact O-NH1 2.86Å; Q121-R123 PolarHBondContact O-N 3.25Å; R123-Y152 CarbonylContact C-O 3.57Å; R123-Y152 WeakPolarHBondContact CA-O 3.13Å
124	V	98.2	Very high	96.3	Very high	42 Å²	42	73.7 Å²	73.7	26%	0.255	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-126.6	127.3	175.7	-172.2	0	0	0	0	108.2	R122 G150 F151 Y152 H206 S208	R122-V124 HydrophobicContact CG-CG2 4.33Å; V124-G150 WeakPolarHBondContact CG1-O 3.25Å; V124-F151 WeakPolarHBondContact O-CA 3.4Å; V124-Y152 PolarHBondContact N-O 3.4Å; V124-Y152 PolarHBondContact O-N 3.27Å; V124-H206 PolarHBondContact O-CE1 2.94Å; V124-H206 VanDerWaalsContact O-CE1 3.24Å; V124-S208 PolarHBondContact O-OG 3.34Å
125	Q	98.1	Very high	95.4	Very high	129 Å²	129	76.9 Å²	76.9	60%	0.603	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-72.7	136.9	-176.5	-64.7	-177.3	7	0	0	112	S208 V209	Q125-S208 VanDerWaalsContact CA-OG 3.25Å; Q125-S208 WeakPolarHBondContact CA-OG 3.4Å; Q125-S208 WeakPolarHBondContact CG-OG 3.36Å; Q125-S208 PolarHBondContact NE2-O 2.72Å; Q125-V209 HydrophobicContact CB-CG1 4.36Å; Q125-V209 HydrophobicContact CG-CG1 3.85Å
126	P	98.5	Very high	94.3	Very high	11 Å²	11	78.2 Å²	78.2	7%	0.071	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-68.5	141.6	175.8	24.9	-30.6	0	0	0	111.5	V128 V148 F151 V204 H206 L213	P126-V128 HydrophobicContact CB-CG2 4.43Å; P126-V148 HydrophobicContact CB-CG1 3.52Å; P126-V148 HydrophobicContact CG-CG1 4.43Å; P126-F151 HydrophobicContact CB-CB 3.76Å; P126-F151 HydrophobicContact CB-CD1 4.01Å; P126-F151 HydrophobicContact CB-CG 4.18Å; P126-F151 HydrophobicContact CG-CB 4.37Å; P126-V204 HydrophobicContact CG-CG1 4.01Å; P126-H206 HydrophobicContact CG-CB 4.26Å; P126-L213 HydrophobicContact CG-CD1 3.74Å
127	K	98.3	Very high	93.2	Very high	145 Å²	145	77.9 Å²	77.9	63%	0.63	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.5	161	-173	-179.8	180	-179.6	0	108.7	V148 S149	K127-V148 WeakPolarHBondContact O-CA 3.42Å; K127-S149 PolarHBondContact N-O 3.45Å; K127-S149 PolarHBondContact O-N 3.2Å; K127-S149 PolarHBondContact O-OG 3.12Å
128	V	98.4	Very high	92	Very high	25 Å²	25	75.1 Å²	75.1	15%	0.152	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128	-177.1	-172.6	0	0	0	0	109.4	P126 S147 V148 V204 L213 V215	P126-V128 HydrophobicContact CB-CG2 4.43Å; V128-S147 WeakPolarHBondContact CA-O 3.46Å; V128-V148 HydrophobicContact CG1-CG2 4.45Å; V128-V148 HydrophobicContact CG2-CG1 4.33Å; V128-V204 HydrophobicContact CG1-CG2 4.06Å; V128-V204 HydrophobicContact CG2-CB 4.17Å; V128-V204 HydrophobicContact CG2-CG2 3.72Å; V128-L213 HydrophobicContact CG2-CD1 4.26Å; V128-V215 HydrophobicContact CB-CG2 3.77Å; V128-V215 HydrophobicContact CG1-CB 4.12Å; V128-V215 HydrophobicContact CG1-CG2 3.59Å
129	T	97.9	Very high	91	Very high	61 Å²	61	76.8 Å²	76.8	37%	0.374	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.6	175.9	-49.7	0	0	0	0	109.3	Y131 S147	T129-Y131 HydrophobicContact CG2-CD1 4.11Å; T129-S147 PolarHBondContact N-O 2.66Å; T129-S147 PolarHBondContact O-N 3.05Å
130	V	97.3	Very high	90.3	Very high	20 Å²	20	80.6 Å²	80.6	12%	0.121	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.3	177.8	180	0	0	0	0	110.4	V145 C146 W160 C202 V215 W217	V130-V145 WeakPolarHBondContact CA-O 3.48Å; V130-C146 HydrophobicContact CG2-CB 4.28Å; V130-W160 HydrophobicContact CG1-CH2 3.61Å; V130-W160 HydrophobicContact CG1-CZ3 4.17Å; V130-W160 HydrophobicContact CG2-CH2 4.31Å; V130-C202 HydrophobicContact CG2-CB 3.62Å; V130-V215 HydrophobicContact CB-CG1 4.06Å; V130-V215 HydrophobicContact CG2-CB 3.9Å; V130-V215 HydrophobicContact CG2-CG1 3.71Å; V130-W217 HydrophobicContact CB-CB 4.37Å; V130-W217 HydrophobicContact CG1-CB 3.56Å; V130-W217 HydrophobicContact CG1-CG 4.18Å
131	Y	94.2	Very high	89.9	Confident	91 Å²	91	85.1 Å²	85.1	36%	0.357	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	153.4	178.9	55.9	-88.4	0	0	0	111.4	T129 V145	T129-Y131 HydrophobicContact CG2-CD1 4.11Å; Y131-V145 HydrophobicContact CD2-CB 4.19Å; Y131-V145 HydrophobicContact CE1-CB 4.4Å; Y131-V145 HydrophobicContact CE1-CG1 4.31Å; Y131-V145 HydrophobicContact CE2-CB 3.79Å; Y131-V145 HydrophobicContact CE2-CG1 4.1Å; Y131-V145 HydrophobicContact CE2-CG2 4.09Å; Y131-V145 PolarHBondContact N-O 2.98Å; Y131-V145 PolarHBondContact O-N 2.73Å
132	P	94	Very high	89.6	Confident	39 Å²	39	81 Å²	81	25%	0.253	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	141	170.7	31.5	-33.3	0	0	0	110.4	K134 L144	P132-K134 VanDerWaalsContact C-N 3.26Å; P132-K134 PolarHBondContact O-N 3.49Å; P132-L144 HydrophobicContact CB-CD2 4.06Å
133	S	91.2	Very high	89.4	Confident	64 Å²	64	79.4 Å²	79.4	45%	0.448	40%	0.398	S	S	.	.	S	Bend	trans	-61.9	-35.4	177.6	172	0	0	0	0	112.2	L143	S133-L143 WeakPolarHBondContact CB-O 3.47Å; S133-L143 PolarHBondContact N-O 3.1Å
134	K	86	Confident	89.3	Confident	129 Å²	129	74 Å²	74	56%	0.561	38%	0.378	S	S	*	.	S	Bend	trans	-130.8	141.7	176	-63.8	179.5	-177.6	174.9	0	110.1	P132 Q136 N142	P132-K134 VanDerWaalsContact C-N 3.26Å; P132-K134 PolarHBondContact O-N 3.49Å; K134-Q136 VanDerWaalsContact C-N 3.33Å; K134-Q136 HydrophobicContact CB-CG 4.05Å; K134-Q136 PolarHBondContact O-N 3Å; K134-N142 PolarHBondContact N-OD1 2.98Å; K134-N142 PolarHBondContact O-ND2 3.42Å
135	T	78.4	Confident	89.2	Confident	150 Å²	150	72.4 Å²	72.4	92%	0.92	37%	0.368	S	S	*	.			trans	-74	88.6	168.7	-46.7	0	0	0	0	108.6
136	Q	75.2	Confident	89.2	Confident	77 Å²	77	66.3 Å²	66.3	36%	0.36	34%	0.339	S	S	.	.			trans	-116.3	151.9	176.3	-72.5	-169.2	9.5	0	0	110.7	K134 H141	K134-Q136 VanDerWaalsContact C-N 3.33Å; K134-Q136 HydrophobicContact CB-CG 4.05Å; K134-Q136 PolarHBondContact O-N 3Å; Q136-H141 PolarHBondContact OE1-O 2.61Å; Q136-H141 VanDerWaalsContact OE1-O 3.08Å
137	P	73.8	Confident	89.2	Confident	59 Å²	59	66.7 Å²	66.7	38%	0.383	34%	0.343	S	S	.	.			trans	-57	155.5	169.8	-15.8	27.2	0	0	0	110.6	E222	P137-E222 WeakPolarHBondContact CB-OE1 3.4Å
138	L	72.1	Confident	89.2	Confident	34 Å²	34	59.8 Å²	59.8	18%	0.178	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	160.8	171.7	-62.7	-173.4	0	0	0	110.9	H140 P194 A219	L138-H140 PolarHBondContact O-N 3.47Å; L138-P194 HydrophobicContact CD2-CB 3.95Å; L138-A219 HydrophobicContact CD1-CB 4.48Å; L138-A219 HydrophobicContact CD2-CB 3.92Å
139	Q	72.9	Confident	89.2	Confident	152 Å²	152	60.2 Å²	60.2	71%	0.71	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	11.5	-177.7	-49.9	175.2	-6.8	0	0	115.5	P194	Q139-P194 PolarHBondContact N-O 3.4Å
140	H	84	Confident	89.3	Confident	103 Å²	103	58.5 Å²	58.5	48%	0.477	31%	0.311	S	S	.	.	S	Bend	trans	-109.6	154.8	167	-66.6	-75.7	0	0	0	111.7	L138 N142	L138-H140 PolarHBondContact O-N 3.47Å; H140-N142 PolarHBondContact O-N 2.89Å
141	H	88.2	Confident	89.3	Confident	152 Å²	152	57.6 Å²	57.6	70%	0.704	31%	0.306	S	S	*	.			trans	-59.9	125.5	174.7	-84.3	-75.4	0	0	0	111	Q136	Q136-H141 PolarHBondContact OE1-O 2.61Å; Q136-H141 VanDerWaalsContact OE1-O 3.08Å
142	N	89.2	Confident	89.5	Confident	18 Å²	18	55.3 Å²	55.3	10%	0.096	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	161.8	176.8	-149.4	-23.8	0	0	0	110.5	K134 H140 T192	K134-N142 PolarHBondContact N-OD1 2.98Å; K134-N142 PolarHBondContact O-ND2 3.42Å; H140-N142 PolarHBondContact O-N 2.89Å; N142-T192 PolarHBondContact N-O 2.83Å; N142-T192 PolarHBondContact O-N 2.78Å
143	L	93	Very high	89.7	Confident	54 Å²	54	54.7 Å²	54.7	28%	0.283	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	112.4	171.2	-79.5	165.1	0	0	0	107.5	S133 M189 L190 E191	S133-L143 WeakPolarHBondContact CB-O 3.47Å; S133-L143 PolarHBondContact N-O 3.1Å; L143-M189 HydrophobicContact CD2-CB 4.15Å; L143-L190 WeakPolarHBondContact CA-O 3.21Å; L143-E191 HydrophobicContact CD2-CB 4.29Å; L143-E191 HydrophobicContact CD2-CG 3.3Å; L143-E191 HydrophobicContact CG-CG 4.32Å
144	L	95.7	Very high	90	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.9	168	-66.8	179.9	0	0	0	108.4	P132 W160 M189 L190 T192 Y200 W217	P132-L144 HydrophobicContact CB-CD2 4.06Å; L144-W160 HydrophobicContact CB-CH2 3.83Å; L144-W160 HydrophobicContact CB-CZ2 4.17Å; L144-W160 HydrophobicContact CB-CZ3 4.49Å; L144-W160 WeakPolarHBondContact O-CZ2 3.39Å; L144-M189 CarbonylContact O-C 3.57Å; L144-M189 WeakPolarHBondContact O-CA 3.45Å; L144-L190 PolarHBondContact N-O 2.82Å; L144-L190 PolarHBondContact O-N 2.98Å; L144-T192 HydrophobicContact CD1-CG2 3.99Å; L144-T192 HydrophobicContact CG-CG2 4.06Å; L144-Y200 HydrophobicContact CD1-CD1 3.41Å; L144-Y200 VanDerWaalsContact CD1-CD1 3.41Å; L144-Y200 HydrophobicContact CD1-CD2 3.72Å; L144-Y200 HydrophobicContact CD1-CE1 3.78Å; L144-Y200 HydrophobicContact CD1-CE2 4.07Å; L144-Y200 HydrophobicContact CD1-CG 3.33Å; L144-W217 HydrophobicContact CD1-CD2 4.29Å; L144-W217 HydrophobicContact CD1-CE3 3.59Å; L144-W217 HydrophobicContact CD1-CZ3 3.8Å; L144-W217 HydrophobicContact CD2-CD2 3.73Å; L144-W217 HydrophobicContact CD2-CE3 3.71Å; L144-W217 HydrophobicContact CD2-CG 4.42Å; L144-W217 HydrophobicContact CD2-CH2 3.92Å; L144-W217 HydrophobicContact CD2-CZ2 3.93Å; L144-W217 HydrophobicContact CD2-CZ3 3.8Å; L144-W217 HydrophobicContact CG-CE3 4.32Å; L144-W217 HydrophobicContact CG-CZ3 4.4Å
145	V	97.5	Very high	90.6	Very high	8 Å²	8	49.8 Å²	49.8	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.7	-177.1	-173.7	0	0	0	0	109.1	V130 Y131 L187 M189	V130-V145 WeakPolarHBondContact CA-O 3.48Å; Y131-V145 HydrophobicContact CD2-CB 4.19Å; Y131-V145 HydrophobicContact CE1-CB 4.4Å; Y131-V145 HydrophobicContact CE1-CG1 4.31Å; Y131-V145 HydrophobicContact CE2-CB 3.79Å; Y131-V145 HydrophobicContact CE2-CG1 4.1Å; Y131-V145 HydrophobicContact CE2-CG2 4.09Å; Y131-V145 PolarHBondContact N-O 2.98Å; Y131-V145 PolarHBondContact O-N 2.73Å; V145-L187 HydrophobicContact CG1-CB 4.31Å; V145-L187 HydrophobicContact CG1-CD2 3.95Å; V145-L187 HydrophobicContact CG1-CG 4.34Å; V145-M189 HydrophobicContact CB-CG 4.35Å; V145-M189 HydrophobicContact CG1-CG 4.12Å; V145-M189 HydrophobicContact CG2-CG 3.98Å
146	C	98.3	Very high	91.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	103.5	163.8	-173.7	0	0	0	0	108.3	V130 W160 L187 V188 C202	V130-C146 HydrophobicContact CG2-CB 4.28Å; C146-W160 HydrophobicContact CB-CH2 4.09Å; C146-W160 HydrophobicContact CB-CZ2 3.48Å; C146-W160 VanDerWaalsContact CB-CZ2 3.48Å; C146-L187 WeakPolarHBondContact O-CA 3.38Å; C146-V188 WeakPolarHBondContact CB-O 3.42Å; C146-V188 PolarHBondContact N-O 3.49Å; C146-V188 PolarHBondContact O-N 2.92Å; C146-C202 HydrophobicContact CB-CB 3.64Å; C146-C202 WeakPolarHBondContact CB-SG 3.25Å; C146-C202 WeakPolarHBondContact SG-CB 3.37Å; C146-C202 CovalentContact SG-SG 2.02Å; C146-C202 PolarHBondContact SG-SG 3.44Å
147	S	98.3	Very high	92.6	Very high	20 Å²	20	45.2 Å²	45.2	14%	0.14	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	116.8	175.1	-179.5	0	0	0	0	109	V128 T129	V128-S147 WeakPolarHBondContact CA-O 3.46Å; T129-S147 PolarHBondContact N-O 2.66Å; T129-S147 PolarHBondContact O-N 3.05Å
148	V	98.6	Very high	93.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	116.9	178.9	-170.2	0	0	0	0	107.6	P126 K127 V128 F151 I156 V158 Q185 T186 V204	P126-V148 HydrophobicContact CB-CG1 3.52Å; P126-V148 HydrophobicContact CG-CG1 4.43Å; K127-V148 WeakPolarHBondContact O-CA 3.42Å; V128-V148 HydrophobicContact CG1-CG2 4.45Å; V128-V148 HydrophobicContact CG2-CG1 4.33Å; V148-F151 HydrophobicContact CB-CE1 4.39Å; V148-F151 HydrophobicContact CG1-CD1 3.96Å; V148-F151 HydrophobicContact CG1-CE1 3.92Å; V148-I156 HydrophobicContact CG1-CD1 3.55Å; V148-V158 HydrophobicContact CG2-CG1 4.4Å; V148-V158 HydrophobicContact CG2-CG2 4.06Å; V148-Q185 CarbonylContact O-C 3.5Å; V148-Q185 VanDerWaalsContact O-CA 3.26Å; V148-Q185 WeakPolarHBondContact O-CA 3.37Å; V148-T186 HydrophobicContact CB-CG2 4.06Å; V148-T186 PolarHBondContact N-O 3.1Å; V148-T186 PolarHBondContact O-N 3.26Å; V148-T186 VanDerWaalsContact O-O 3.14Å; V148-V204 HydrophobicContact CG1-CG1 4.06Å; V148-V204 HydrophobicContact CG1-CG2 4.33Å; V148-V204 HydrophobicContact CG2-CG2 3.77Å
149	S	98.4	Very high	95	Very high	33 Å²	33	44.9 Å²	44.9	23%	0.231	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	155.4	-167.6	57.8	0	0	0	0	113.2	K127 F151	K127-S149 PolarHBondContact N-O 3.45Å; K127-S149 PolarHBondContact O-N 3.2Å; K127-S149 PolarHBondContact O-OG 3.12Å; S149-F151 PolarHBondContact O-N 3.13Å
150	G	98.1	Very high	96.2	Very high	26 Å²	26	37.7 Å²	37.7	27%	0.268	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	77.3	19.1	169.5	0	0	0	0	0	114.9	V124 F184	V124-G150 WeakPolarHBondContact CG1-O 3.25Å; G150-F184 PolarHBondContact N-O 2.9Å
151	F	98.6	Very high	96.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	160.6	-175.5	61.2	-88.4	0	0	0	113.6	V124 P126 V148 S149 P153 I156 L176 T183 F184 T186 H206	V124-F151 WeakPolarHBondContact O-CA 3.4Å; P126-F151 HydrophobicContact CB-CB 3.76Å; P126-F151 HydrophobicContact CB-CD1 4.01Å; P126-F151 HydrophobicContact CB-CG 4.18Å; P126-F151 HydrophobicContact CG-CB 4.37Å; V148-F151 HydrophobicContact CB-CE1 4.39Å; V148-F151 HydrophobicContact CG1-CD1 3.96Å; V148-F151 HydrophobicContact CG1-CE1 3.92Å; S149-F151 PolarHBondContact O-N 3.13Å; F151-P153 WeakPolarHBondContact CD2-O 3.46Å; F151-I156 HydrophobicContact CD1-CD1 3.9Å; F151-I156 HydrophobicContact CD2-CB 4.46Å; F151-I156 HydrophobicContact CD2-CD1 3.85Å; F151-I156 HydrophobicContact CE1-CD1 3.71Å; F151-I156 HydrophobicContact CE2-CB 3.86Å; F151-I156 HydrophobicContact CE2-CD1 3.67Å; F151-I156 HydrophobicContact CE2-CG1 4.38Å; F151-I156 HydrophobicContact CE2-CG2 3.79Å; F151-I156 HydrophobicContact CG-CD1 3.97Å; F151-I156 HydrophobicContact CZ-CB 4.25Å; F151-I156 HydrophobicContact CZ-CD1 3.61Å; F151-I156 HydrophobicContact CZ-CG2 3.8Å; F151-L176 HydrophobicContact CE2-CD1 3.89Å; F151-L176 HydrophobicContact CZ-CD1 3.8Å; F151-T183 CarbonylContact O-C 3.58Å; F151-T183 WeakPolarHBondContact O-CA 3.38Å; F151-F184 WeakPolarHBondContact CD1-O 3.32Å; F151-F184 HydrophobicContact CD2-CB 4.06Å; F151-F184 HydrophobicContact CE1-CB 4.25Å; F151-F184 WeakPolarHBondContact CE1-O 3.44Å; F151-F184 HydrophobicContact CE2-CB 3.61Å; F151-F184 HydrophobicContact CE2-CG 4.47Å; F151-F184 HydrophobicContact CZ-CB 3.7Å; F151-F184 PolarHBondContact N-O 3.03Å; F151-F184 PolarHBondContact O-N 3.18Å; F151-T186 HydrophobicContact CE1-CG2 4.42Å; F151-T186 HydrophobicContact CZ-CG2 4.33Å; F151-H206 AromaticContact CD2-CD2 3.82Å; F151-H206 AromaticContact CD2-NE2 3.64Å
152	Y	98.6	Very high	97.2	Very high	43 Å²	43	28.5 Å²	28.5	17%	0.169	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-156.9	138.2	173.3	-170.8	-82.5	0	0	0	109.9	R122 R123 V124 W182 F184 H206	R122-Y152 HydrophobicContact CB-CD1 3.76Å; R122-Y152 HydrophobicContact CB-CE1 3.77Å; R122-Y152 HydrophobicContact CG-CD1 3.63Å; R122-Y152 HydrophobicContact CG-CE1 4.05Å; R122-Y152 HydrophobicContact CG-CG 4.29Å; R122-Y152 WeakPolarHBondContact O-CD1 3.39Å; R123-Y152 CarbonylContact C-O 3.57Å; R123-Y152 WeakPolarHBondContact CA-O 3.13Å; V124-Y152 PolarHBondContact N-O 3.4Å; V124-Y152 PolarHBondContact O-N 3.27Å; Y152-W182 WeakPolarHBondContact CD2-O 3.28Å; Y152-W182 HydrophobicContact CE2-CE3 4.02Å; Y152-F184 HydrophobicContact CD2-CD2 4.08Å; Y152-F184 AromaticContact CD2-CE2 3.63Å; Y152-F184 HydrophobicContact CD2-CE2 3.63Å; Y152-F184 AromaticContact CE2-CE2 3.87Å; Y152-F184 HydrophobicContact CE2-CE2 3.87Å; Y152-H206 PolarHBondContact O-CE1 2.98Å
153	P	98.2	Very high	97.5	Very high	26 Å²	26	32.4 Å²	32.4	17%	0.169	18%	0.183	C	C	.	.	S	Bend	cis	-74.5	-177.9	2.9	33.7	-39.2	0	0	0	113.3	F151 S155 H206 P207	F151-P153 WeakPolarHBondContact CD2-O 3.46Å; P153-S155 VanDerWaalsContact C-N 3.25Å; P153-S155 PolarHBondContact O-N 3.48Å; P153-H206 PolarHBondContact O-NE2 3.02Å; P153-P207 HydrophobicContact CG-CG 4.43Å
154	G	97.8	Very high	97.6	Very high	19 Å²	19	32.7 Å²	32.7	20%	0.196	20%	0.199	C	C	.	.	S	Bend	trans	-72.9	-11.5	-176.7	0	0	0	0	0	115.4	I156 L176	G154-I156 PolarHBondContact O-N 3Å; G154-L176 WeakPolarHBondContact O-CD1 3.39Å
155	S	97.3	Very high	97.6	Very high	71 Å²	71	39.7 Å²	39.7	50%	0.497	23%	0.231	S	C	.	.			trans	-73	110.5	179.1	55.2	0	0	0	0	110.5	P153 H206 P207	P153-S155 VanDerWaalsContact C-N 3.25Å; P153-S155 PolarHBondContact O-N 3.48Å; S155-H206 PolarHBondContact O-CD2 2.65Å; S155-H206 VanDerWaalsContact O-CD2 3.25Å; S155-P207 VanDerWaalsContact O-CD 3.25Å; S155-P207 WeakPolarHBondContact O-CD 3.49Å
156	I	98.1	Very high	97.6	Very high	45 Å²	45	43.1 Å²	43.1	23%	0.231	25%	0.247	C	C	.	.			trans	-145.5	147.6	-176.9	-164.6	162.9	0	0	0	110.5	V148 F151 G154 V158 T186 V204 E205 H206	V148-I156 HydrophobicContact CG1-CD1 3.55Å; F151-I156 HydrophobicContact CD1-CD1 3.9Å; F151-I156 HydrophobicContact CD2-CB 4.46Å; F151-I156 HydrophobicContact CD2-CD1 3.85Å; F151-I156 HydrophobicContact CE1-CD1 3.71Å; F151-I156 HydrophobicContact CE2-CB 3.86Å; F151-I156 HydrophobicContact CE2-CD1 3.67Å; F151-I156 HydrophobicContact CE2-CG1 4.38Å; F151-I156 HydrophobicContact CE2-CG2 3.79Å; F151-I156 HydrophobicContact CG-CD1 3.97Å; F151-I156 HydrophobicContact CZ-CB 4.25Å; F151-I156 HydrophobicContact CZ-CD1 3.61Å; F151-I156 HydrophobicContact CZ-CG2 3.8Å; G154-I156 PolarHBondContact O-N 3Å; I156-V158 HydrophobicContact CD1-CG2 4.49Å; I156-V158 HydrophobicContact CG1-CG2 4.26Å; I156-T186 HydrophobicContact CG2-CG2 4.45Å; I156-V204 HydrophobicContact CD1-CG1 3.71Å; I156-V204 HydrophobicContact CG1-CG1 3.94Å; I156-E205 WeakPolarHBondContact CG1-O 3.33Å; I156-H206 HydrophobicContact CD1-CB 4.48Å; I156-H206 HydrophobicContact CG1-CB 4.27Å
157	E	97.7	Very high	97.4	Very high	87 Å²	87	45.7 Å²	45.7	41%	0.407	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.5	170.8	-173.8	173.3	-176.2	0	0	109.7	R159 V204 E205	E157-R159 HydrophobicContact CG-CG 4.38Å; E157-R159 IonicContact OE1-CZ 2.7Å; E157-R159 IonicContact OE1-NE 3.11Å; E157-R159 PolarHBondContact OE1-NE 3.4Å; E157-R159 IonicContact OE1-NH2 3.24Å; E157-R159 PolarHBondContact OE1-NH2 3Å; E157-R159 IonicContact OE2-NH2 3.57Å; E157-R159 PolarHBondContact OE2-NH2 3.48Å; E157-V204 WeakPolarHBondContact O-CA 3.04Å; E157-E205 HydrophobicContact CB-CB 4.29Å; E157-E205 PolarHBondContact N-O 2.85Å; E157-E205 PolarHBondContact O-N 2.79Å
158	V	98.1	Very high	97.2	Very high	18 Å²	18	51.5 Å²	51.5	11%	0.109	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	125	-178.4	-175.6	0	0	0	0	108.3	V148 I156 T186 V188 C202 Q203 V204	V148-V158 HydrophobicContact CG2-CG1 4.4Å; V148-V158 HydrophobicContact CG2-CG2 4.06Å; I156-V158 HydrophobicContact CD1-CG2 4.49Å; I156-V158 HydrophobicContact CG1-CG2 4.26Å; V158-T186 HydrophobicContact CG2-CG2 4.29Å; V158-V188 HydrophobicContact CB-CB 4.32Å; V158-V188 HydrophobicContact CB-CG2 3.78Å; V158-V188 HydrophobicContact CG1-CB 3.82Å; V158-V188 HydrophobicContact CG1-CG1 4.23Å; V158-V188 HydrophobicContact CG1-CG2 3.79Å; V158-V188 HydrophobicContact CG2-CG2 4.18Å; V158-C202 VanDerWaalsContact CG1-SG 3.58Å; V158-Q203 CarbonylContact C-O 3.5Å; V158-Q203 WeakPolarHBondContact CA-O 3.35Å; V158-V204 HydrophobicContact CG1-CG2 4.25Å; V158-V204 HydrophobicContact CG2-CG2 4.23Å
159	R	97.9	Very high	97	Very high	68 Å²	68	55 Å²	55	26%	0.257	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.9	-178.6	-61.2	-176.3	-172.7	165.1	13	110.8	E157 F161 E166 Q203	E157-R159 HydrophobicContact CG-CG 4.38Å; E157-R159 IonicContact OE1-CZ 2.7Å; E157-R159 IonicContact OE1-NE 3.11Å; E157-R159 PolarHBondContact OE1-NE 3.4Å; E157-R159 IonicContact OE1-NH2 3.24Å; E157-R159 PolarHBondContact OE1-NH2 3Å; E157-R159 IonicContact OE2-NH2 3.57Å; E157-R159 PolarHBondContact OE2-NH2 3.48Å; R159-F161 HydrophobicContact CB-CE2 3.83Å; R159-E166 WeakPolarHBondContact CD-OE1 3.01Å; R159-E166 IonicContact NE-OE1 2.73Å; R159-Q203 PolarHBondContact N-O 2.85Å; R159-Q203 PolarHBondContact O-N 2.96Å
160	W	98.2	Very high	96.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	144.7	172.1	-82.7	106.2	0	0	0	110.7	V130 L144 C146 E166 E167 V188 L190 T201 C202	V130-W160 HydrophobicContact CG1-CH2 3.61Å; V130-W160 HydrophobicContact CG1-CZ3 4.17Å; V130-W160 HydrophobicContact CG2-CH2 4.31Å; L144-W160 HydrophobicContact CB-CH2 3.83Å; L144-W160 HydrophobicContact CB-CZ2 4.17Å; L144-W160 HydrophobicContact CB-CZ3 4.49Å; L144-W160 WeakPolarHBondContact O-CZ2 3.39Å; C146-W160 HydrophobicContact CB-CH2 4.09Å; C146-W160 HydrophobicContact CB-CZ2 3.48Å; C146-W160 VanDerWaalsContact CB-CZ2 3.48Å; W160-E166 WeakPolarHBondContact O-CA 3.47Å; W160-E167 HydrophobicContact CB-CB 4.29Å; W160-E167 PolarHBondContact O-N 3.11Å; W160-V188 PolarHBondContact NE1-O 3.31Å; W160-V188 VanDerWaalsContact NE1-O 3.09Å; W160-L190 HydrophobicContact CB-CD2 4.21Å; W160-L190 HydrophobicContact CD2-CB 4.04Å; W160-L190 HydrophobicContact CD2-CD2 4.23Å; W160-L190 HydrophobicContact CE3-CD2 4.33Å; W160-L190 HydrophobicContact CG-CB 4.04Å; W160-L190 HydrophobicContact CG-CD2 4.21Å; W160-L190 HydrophobicContact CZ2-CB 4.42Å; W160-T201 CarbonylContact C-O 3.54Å; W160-T201 WeakPolarHBondContact CA-O 3.45Å; W160-C202 HydrophobicContact CE3-CB 4.27Å; W160-C202 HydrophobicContact CH2-CB 4.25Å; W160-C202 HydrophobicContact CZ3-CB 4.1Å
161	F	97.8	Very high	96.4	Very high	35 Å²	35	57.3 Å²	57.3	15%	0.154	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.4	171.6	-63.9	-103.2	0	0	0	110.3	R159 Q165 E166 Y200 T201 Q203	R159-F161 HydrophobicContact CB-CE2 3.83Å; F161-Q165 CarbonylContact C-O 3.59Å; F161-Q165 WeakPolarHBondContact CA-O 3.35Å; F161-E166 HydrophobicContact CD1-CB 4.02Å; F161-E166 HydrophobicContact CE1-CB 3.75Å; F161-E166 HydrophobicContact CE1-CG 4.24Å; F161-E166 HydrophobicContact CZ-CB 4.29Å; F161-E166 HydrophobicContact CZ-CG 4.28Å; F161-Y200 CarbonylContact O-C 3.56Å; F161-Y200 VanDerWaalsContact O-CA 3.28Å; F161-Y200 WeakPolarHBondContact O-CA 3.31Å; F161-T201 PolarHBondContact N-O 3.37Å; F161-T201 PolarHBondContact O-N 2.97Å; F161-Q203 HydrophobicContact CD2-CB 4.22Å; F161-Q203 HydrophobicContact CE2-CB 3.79Å; F161-Q203 HydrophobicContact CE2-CG 4.49Å; F161-Q203 VanDerWaalsContact CE2-OE1 3.23Å
162	L	96.4	Very high	96.3	Very high	27 Å²	27	60.4 Å²	60.4	14%	0.141	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.8	169.6	173.6	57.8	0	0	0	108.5	G164 Q165 E167 E198 Y200	L162-G164 PolarHBondContact O-N 2.92Å; L162-G164 VanDerWaalsContact O-N 3.08Å; L162-Q165 PolarHBondContact N-O 2.92Å; L162-Q165 PolarHBondContact O-N 3.42Å; L162-E167 HydrophobicContact CB-CG 3.53Å; L162-E198 HydrophobicContact CD1-CB 3.89Å; L162-E198 HydrophobicContact CD1-CG 4.13Å; L162-Y200 HydrophobicContact CD1-CD1 4.03Å; L162-Y200 HydrophobicContact CD1-CD2 4.25Å; L162-Y200 HydrophobicContact CD1-CE1 3.75Å; L162-Y200 HydrophobicContact CD1-CE2 3.97Å; L162-Y200 HydrophobicContact CD1-CG 4.31Å; L162-Y200 HydrophobicContact CD2-CE1 4.49Å; L162-Y200 HydrophobicContact CG-CE1 4.49Å
163	N	95.1	Very high	96.2	Very high	101 Å²	101	61.3 Å²	61.3	54%	0.54	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	34.9	-178.1	-56.5	-34.8	0	0	0	113.3	E198 V199	N163-E198 WeakPolarHBondContact OD1-CA 3.39Å; N163-V199 PolarHBondContact N-O 2.04Å; N163-V199 PolarHBondContact OD1-N 2.94Å
164	G	94.8	Very high	96.1	Very high	60 Å²	60	63.3 Å²	63.3	62%	0.619	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-3.6	-179.2	0	0	0	0	0	115.6	L162	L162-G164 PolarHBondContact O-N 2.92Å; L162-G164 VanDerWaalsContact O-N 3.08Å
165	Q	96.3	Very high	96	Very high	147 Å²	147	64 Å²	64	69%	0.687	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.6	173.7	-64.4	-170.9	-25.8	0	0	110.6	F161 L162 E167	F161-Q165 CarbonylContact C-O 3.59Å; F161-Q165 WeakPolarHBondContact CA-O 3.35Å; L162-Q165 PolarHBondContact N-O 2.92Å; L162-Q165 PolarHBondContact O-N 3.42Å; Q165-E167 PolarHBondContact O-N 2.87Å
166	E	97	Very high	96.1	Very high	79 Å²	79	64.8 Å²	64.8	37%	0.369	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	126	-179.1	-169.7	-175.4	172.9	0	0	110.9	R159 W160 F161 K168	R159-E166 WeakPolarHBondContact CD-OE1 3.01Å; R159-E166 IonicContact NE-OE1 2.73Å; W160-E166 WeakPolarHBondContact O-CA 3.47Å; F161-E166 HydrophobicContact CD1-CB 4.02Å; F161-E166 HydrophobicContact CE1-CB 3.75Å; F161-E166 HydrophobicContact CE1-CG 4.24Å; F161-E166 HydrophobicContact CZ-CB 4.29Å; F161-E166 HydrophobicContact CZ-CG 4.28Å; E166-K168 WeakPolarHBondContact OE1-CE 3.17Å; E166-K168 IonicContact OE1-NZ 3.88Å; E166-K168 IonicContact OE2-NZ 3.13Å
167	E	94.8	Very high	96.1	Very high	54 Å²	54	65.6 Å²	65.6	25%	0.252	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.5	179.3	-74.2	-63.9	165	0	0	110.5	W160 L162 Q165 L190	W160-E167 HydrophobicContact CB-CB 4.29Å; W160-E167 PolarHBondContact O-N 3.11Å; L162-E167 HydrophobicContact CB-CG 3.53Å; Q165-E167 PolarHBondContact O-N 2.87Å; E167-L190 HydrophobicContact CB-CD1 4.13Å; E167-L190 HydrophobicContact CB-CD2 4.43Å
168	K	93.9	Very high	96.1	Very high	142 Å²	142	68.6 Å²	68.6	62%	0.617	39%	0.387	S	S	*	.			trans	-112.1	-28.4	176.1	-62.5	-175.7	-178.7	-179.1	0	112.4	E166 M171	E166-K168 WeakPolarHBondContact OE1-CE 3.17Å; E166-K168 IonicContact OE1-NZ 3.88Å; E166-K168 IonicContact OE2-NZ 3.13Å; K168-M171 PolarHBondContact O-N 2.97Å
169	A	93.5	Very high	96	Very high	75 Å²	75	70.6 Å²	70.6	62%	0.62	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	136.8	179.5	0	0	0	0	0	110.1	M171 L190	A169-M171 PolarHBondContact O-N 3.09Å; A169-L190 WeakPolarHBondContact O-CD1 3.35Å
170	G	90	Very high	96	Very high	29 Å²	29	70.5 Å²	70.5	30%	0.299	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	7.9	-179.1	0	0	0	0	0	114.8	E191	G170-E191 PolarHBondContact O-N 2.91Å
171	M	95.1	Very high	96	Very high	78 Å²	78	75 Å²	75	38%	0.384	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	128.6	175.7	-168.9	176.6	69.2	0	0	110.9	K168 A169 V188 M189	K168-M171 PolarHBondContact O-N 2.97Å; A169-M171 PolarHBondContact O-N 3.09Å; M171-V188 HydrophobicContact CG-CG1 3.6Å; M171-V188 HydrophobicContact SD-CG1 3.56Å; M171-V188 VanDerWaalsContact SD-CG1 3.56Å; M171-M189 CarbonylContact C-O 3.44Å; M171-M189 VanDerWaalsContact CA-O 3.26Å; M171-M189 WeakPolarHBondContact CA-O 3.37Å
172	V	95.3	Very high	95.9	Very high	65 Å²	65	80.3 Å²	80.3	39%	0.394	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.2	178.1	-177.5	0	0	0	0	109.1	M189	V172-M189 HydrophobicContact CB-CE 4.25Å; V172-M189 HydrophobicContact CG1-CE 3.99Å; V172-M189 PolarHBondContact N-O 2.91Å; V172-M189 WeakPolarHBondContact O-CE 3.31Å; V172-M189 PolarHBondContact O-N 2.95Å
173	S	96.5	Very high	96	Very high	62 Å²	62	79.8 Å²	79.8	43%	0.434	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.9	177.2	177.5	0	0	0	0	111.4	G175 T186 L187	S173-G175 PolarHBondContact O-N 2.65Å; S173-G175 PolarHBondContact OG-N 3.43Å; S173-T186 PolarHBondContact OG-OG1 3.4Å; S173-L187 VanDerWaalsContact CA-O 3.3Å; S173-L187 WeakPolarHBondContact CA-O 3.46Å
174	T	96.1	Very high	96.2	Very high	67 Å²	67	76.3 Å²	76.3	41%	0.411	44%	0.438	S	S	.	.			trans	-71.7	-7	168.1	57	0	0	0	0	113.4	L187 M189	T174-L187 HydrophobicContact CG2-CB 3.81Å; T174-L187 HydrophobicContact CG2-CD1 4.32Å; T174-L187 PolarHBondContact N-O 3.21Å; T174-L187 PolarHBondContact OG1-N 3.15Å; T174-M189 HydrophobicContact CG2-CE 4.2Å
175	G	96.8	Very high	96.4	Very high	35 Å²	35	76.4 Å²	76.4	36%	0.361	42%	0.423	S	S	.	.			trans	71.3	-170	-162.9	0	0	0	0	0	111.6	S173 T186	S173-G175 PolarHBondContact O-N 2.65Å; S173-G175 PolarHBondContact OG-N 3.43Å; G175-T186 WeakPolarHBondContact O-CB 3.31Å; G175-T186 PolarHBondContact O-OG1 3.27Å
176	L	97.6	Very high	96.5	Very high	86 Å²	86	69.7 Å²	69.7	45%	0.45	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-85.1	120.8	-179.9	-172.5	71.2	0	0	0	110.3	F151 G154 F184	F151-L176 HydrophobicContact CE2-CD1 3.89Å; F151-L176 HydrophobicContact CZ-CD1 3.8Å; G154-L176 WeakPolarHBondContact O-CD1 3.39Å; L176-F184 HydrophobicContact CD1-CB 3.66Å; L176-F184 HydrophobicContact CD1-CD1 3.79Å; L176-F184 HydrophobicContact CD1-CG 3.88Å; L176-F184 HydrophobicContact CD2-CD1 3.66Å; L176-F184 HydrophobicContact CD2-CE1 3.76Å; L176-F184 HydrophobicContact CD2-CG 4.34Å; L176-F184 HydrophobicContact CG-CB 4.37Å; L176-F184 HydrophobicContact CG-CD1 3.57Å; L176-F184 HydrophobicContact CG-CE1 4.16Å; L176-F184 HydrophobicContact CG-CG 4.19Å
177	I	98.3	Very high	96.5	Very high	62 Å²	62	67.9 Å²	67.9	32%	0.318	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.9	177.1	-59.6	167.4	0	0	0	108.5	F184 Q185	I177-F184 CarbonylContact O-C 3.56Å; I177-F184 VanDerWaalsContact O-CA 3.24Å; I177-F184 WeakPolarHBondContact O-CA 3.27Å; I177-Q185 HydrophobicContact CB-CG 3.67Å; I177-Q185 WeakPolarHBondContact CB-O 3.4Å; I177-Q185 HydrophobicContact CD1-CG 4.17Å; I177-Q185 HydrophobicContact CG1-CG 4.47Å; I177-Q185 HydrophobicContact CG2-CG 3.9Å; I177-Q185 PolarHBondContact N-O 3.07Å; I177-Q185 PolarHBondContact O-N 2.98Å
178	Q	97.9	Very high	96.7	Very high	150 Å²	150	65.6 Å²	65.6	70%	0.701	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.3	174.9	-171.2	174.8	-2	0	0	110	F184	Q178-F184 HydrophobicContact CB-CD1 4.1Å; Q178-F184 HydrophobicContact CB-CE1 3.9Å; Q178-F184 HydrophobicContact CG-CD1 4.35Å; Q178-F184 HydrophobicContact CG-CE1 3.88Å; Q178-F184 HydrophobicContact CG-CZ 4.49Å
179	N	97.7	Very high	96.8	Very high	60 Å²	60	60.5 Å²	60.5	32%	0.321	35%	0.353	S	S	.	.			trans	-81.2	-16.1	-173.4	-66	-26.7	0	0	0	114	D181 T183 Q185	N179-D181 VanDerWaalsContact C-N 3.3Å; N179-D181 VanDerWaalsContact CB-OD1 3.25Å; N179-D181 WeakPolarHBondContact CB-OD1 3.27Å; N179-T183 WeakPolarHBondContact CB-O 3.48Å; N179-T183 PolarHBondContact N-O 3.37Å; N179-T183 VanDerWaalsContact N-O 3.1Å; N179-T183 PolarHBondContact ND2-OG1 3.05Å; N179-Q185 WeakPolarHBondContact OD1-CG 3.25Å; N179-Q185 PolarHBondContact OD1-NE2 2.92Å
180	G	97.1	Very high	97	Very high	66 Å²	66	57.1 Å²	57.1	68%	0.68	32%	0.324	S	S	*	.	S	Bend	trans	85.7	-6.6	-175.3	0	0	0	0	0	114.8
181	D	97.6	Very high	97.3	Very high	96 Å²	96	61.2 Å²	61.2	51%	0.513	34%	0.336	S	S	.	.	S	Bend	trans	-106.4	21.6	179.6	69.5	-8.2	0	0	0	113.3	N179 T183	N179-D181 VanDerWaalsContact C-N 3.3Å; N179-D181 VanDerWaalsContact CB-OD1 3.25Å; N179-D181 WeakPolarHBondContact CB-OD1 3.27Å; D181-T183 VanDerWaalsContact C-N 3.29Å; D181-T183 PolarHBondContact O-N 3.06Å; D181-T183 WeakPolarHBondContact OD1-CB 3.29Å; D181-T183 PolarHBondContact OD1-N 2.98Å; D181-T183 PolarHBondContact OD1-OG1 3.33Å; D181-T183 PolarHBondContact OD2-OG1 3.16Å
182	W	97.1	Very high	97.2	Very high	145 Å²	145	58.6 Å²	58.6	55%	0.549	32%	0.324	S	S	.	.	S	Bend	trans	64.6	28.1	-172.4	-62	72.1	0	0	0	114.7	T119 Y152	T119-W182 HydrophobicContact CG2-CH2 4.04Å; T119-W182 HydrophobicContact CG2-CZ3 4.08Å; Y152-W182 WeakPolarHBondContact CD2-O 3.28Å; Y152-W182 HydrophobicContact CE2-CE3 4.02Å
183	T	98.4	Very high	97.1	Very high	17 Å²	17	57.8 Å²	57.8	10%	0.104	32%	0.319	C	S	.	.			trans	-127	161.7	166.3	72.6	0	0	0	0	111.7	F151 N179 D181	F151-T183 CarbonylContact O-C 3.58Å; F151-T183 WeakPolarHBondContact O-CA 3.38Å; N179-T183 WeakPolarHBondContact CB-O 3.48Å; N179-T183 PolarHBondContact N-O 3.37Å; N179-T183 VanDerWaalsContact N-O 3.1Å; N179-T183 PolarHBondContact ND2-OG1 3.05Å; D181-T183 VanDerWaalsContact C-N 3.29Å; D181-T183 PolarHBondContact O-N 3.06Å; D181-T183 WeakPolarHBondContact OD1-CB 3.29Å; D181-T183 PolarHBondContact OD1-N 2.98Å; D181-T183 PolarHBondContact OD1-OG1 3.33Å; D181-T183 PolarHBondContact OD2-OG1 3.16Å
184	F	98.7	Very high	96.8	Very high	27 Å²	27	55 Å²	55	12%	0.118	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	161.7	174.3	-62.5	-86.6	0	0	0	111.1	G150 F151 Y152 L176 I177 Q178	G150-F184 PolarHBondContact N-O 2.9Å; F151-F184 WeakPolarHBondContact CD1-O 3.32Å; F151-F184 HydrophobicContact CD2-CB 4.06Å; F151-F184 HydrophobicContact CE1-CB 4.25Å; F151-F184 WeakPolarHBondContact CE1-O 3.44Å; F151-F184 HydrophobicContact CE2-CB 3.61Å; F151-F184 HydrophobicContact CE2-CG 4.47Å; F151-F184 HydrophobicContact CZ-CB 3.7Å; F151-F184 PolarHBondContact N-O 3.03Å; F151-F184 PolarHBondContact O-N 3.18Å; Y152-F184 HydrophobicContact CD2-CD2 4.08Å; Y152-F184 AromaticContact CD2-CE2 3.63Å; Y152-F184 HydrophobicContact CD2-CE2 3.63Å; Y152-F184 AromaticContact CE2-CE2 3.87Å; Y152-F184 HydrophobicContact CE2-CE2 3.87Å; L176-F184 HydrophobicContact CD1-CB 3.66Å; L176-F184 HydrophobicContact CD1-CD1 3.79Å; L176-F184 HydrophobicContact CD1-CG 3.88Å; L176-F184 HydrophobicContact CD2-CD1 3.66Å; L176-F184 HydrophobicContact CD2-CE1 3.76Å; L176-F184 HydrophobicContact CD2-CG 4.34Å; L176-F184 HydrophobicContact CG-CB 4.37Å; L176-F184 HydrophobicContact CG-CD1 3.57Å; L176-F184 HydrophobicContact CG-CE1 4.16Å; L176-F184 HydrophobicContact CG-CG 4.19Å; I177-F184 CarbonylContact O-C 3.56Å; I177-F184 VanDerWaalsContact O-CA 3.24Å; I177-F184 WeakPolarHBondContact O-CA 3.27Å; Q178-F184 HydrophobicContact CB-CD1 4.1Å; Q178-F184 HydrophobicContact CB-CE1 3.9Å; Q178-F184 HydrophobicContact CG-CD1 4.35Å; Q178-F184 HydrophobicContact CG-CE1 3.88Å; Q178-F184 HydrophobicContact CG-CZ 4.49Å
185	Q	98.4	Very high	96.6	Very high	62 Å²	62	59.6 Å²	59.6	29%	0.29	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	156.7	167.3	66.3	-179.3	-51.1	0	0	110.8	V148 I177 N179	V148-Q185 CarbonylContact O-C 3.5Å; V148-Q185 VanDerWaalsContact O-CA 3.26Å; V148-Q185 WeakPolarHBondContact O-CA 3.37Å; I177-Q185 HydrophobicContact CB-CG 3.67Å; I177-Q185 WeakPolarHBondContact CB-O 3.4Å; I177-Q185 HydrophobicContact CD1-CG 4.17Å; I177-Q185 HydrophobicContact CG1-CG 4.47Å; I177-Q185 HydrophobicContact CG2-CG 3.9Å; I177-Q185 PolarHBondContact N-O 3.07Å; I177-Q185 PolarHBondContact O-N 2.98Å; N179-Q185 WeakPolarHBondContact OD1-CG 3.25Å; N179-Q185 PolarHBondContact OD1-NE2 2.92Å
186	T	98.5	Very high	96.2	Very high	7 Å²	7	61.8 Å²	61.8	4%	0.043	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	145.9	170.4	-169.9	0	0	0	0	109.3	V148 F151 I156 V158 S173 G175 V188	V148-T186 HydrophobicContact CB-CG2 4.06Å; V148-T186 PolarHBondContact N-O 3.1Å; V148-T186 PolarHBondContact O-N 3.26Å; V148-T186 VanDerWaalsContact O-O 3.14Å; F151-T186 HydrophobicContact CE1-CG2 4.42Å; F151-T186 HydrophobicContact CZ-CG2 4.33Å; I156-T186 HydrophobicContact CG2-CG2 4.45Å; V158-T186 HydrophobicContact CG2-CG2 4.29Å; S173-T186 PolarHBondContact OG-OG1 3.4Å; G175-T186 WeakPolarHBondContact O-CB 3.31Å; G175-T186 PolarHBondContact O-OG1 3.27Å; T186-V188 HydrophobicContact CG2-CG2 4.43Å
187	L	98	Very high	95.8	Very high	40 Å²	40	60.6 Å²	60.6	21%	0.209	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.1	171	-68.6	75.3	0	0	0	107.4	V145 C146 S173 T174	V145-L187 HydrophobicContact CG1-CB 4.31Å; V145-L187 HydrophobicContact CG1-CD2 3.95Å; V145-L187 HydrophobicContact CG1-CG 4.34Å; C146-L187 WeakPolarHBondContact O-CA 3.38Å; S173-L187 VanDerWaalsContact CA-O 3.3Å; S173-L187 WeakPolarHBondContact CA-O 3.46Å; T174-L187 HydrophobicContact CG2-CB 3.81Å; T174-L187 HydrophobicContact CG2-CD1 4.32Å; T174-L187 PolarHBondContact N-O 3.21Å; T174-L187 PolarHBondContact OG1-N 3.15Å
188	V	97.9	Very high	95.6	Very high	6 Å²	6	59.1 Å²	59.1	4%	0.036	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.2	174.5	-174.8	0	0	0	0	108.3	C146 V158 W160 M171 T186	C146-V188 WeakPolarHBondContact CB-O 3.42Å; C146-V188 PolarHBondContact N-O 3.49Å; C146-V188 PolarHBondContact O-N 2.92Å; V158-V188 HydrophobicContact CB-CB 4.32Å; V158-V188 HydrophobicContact CB-CG2 3.78Å; V158-V188 HydrophobicContact CG1-CB 3.82Å; V158-V188 HydrophobicContact CG1-CG1 4.23Å; V158-V188 HydrophobicContact CG1-CG2 3.79Å; V158-V188 HydrophobicContact CG2-CG2 4.18Å; W160-V188 PolarHBondContact NE1-O 3.31Å; W160-V188 VanDerWaalsContact NE1-O 3.09Å; M171-V188 HydrophobicContact CG-CG1 3.6Å; M171-V188 HydrophobicContact SD-CG1 3.56Å; M171-V188 VanDerWaalsContact SD-CG1 3.56Å; T186-V188 HydrophobicContact CG2-CG2 4.43Å
189	M	97.1	Very high	95.5	Very high	35 Å²	35	53.8 Å²	53.8	17%	0.172	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	144.9	-171.7	-61.6	158.1	-76.5	0	0	109.8	L143 L144 V145 M171 V172 T174	L143-M189 HydrophobicContact CD2-CB 4.15Å; L144-M189 CarbonylContact O-C 3.57Å; L144-M189 WeakPolarHBondContact O-CA 3.45Å; V145-M189 HydrophobicContact CB-CG 4.35Å; V145-M189 HydrophobicContact CG1-CG 4.12Å; V145-M189 HydrophobicContact CG2-CG 3.98Å; M171-M189 CarbonylContact C-O 3.44Å; M171-M189 VanDerWaalsContact CA-O 3.26Å; M171-M189 WeakPolarHBondContact CA-O 3.37Å; V172-M189 HydrophobicContact CB-CE 4.25Å; V172-M189 HydrophobicContact CG1-CE 3.99Å; V172-M189 PolarHBondContact N-O 2.91Å; V172-M189 WeakPolarHBondContact O-CE 3.31Å; V172-M189 PolarHBondContact O-N 2.95Å; T174-M189 HydrophobicContact CG2-CE 4.2Å
190	L	97.2	Very high	95.4	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117	174.6	-179.1	68.6	0	0	0	109.5	L143 L144 W160 E167 A169 T192 Y200	L143-L190 WeakPolarHBondContact CA-O 3.21Å; L144-L190 PolarHBondContact N-O 2.82Å; L144-L190 PolarHBondContact O-N 2.98Å; W160-L190 HydrophobicContact CB-CD2 4.21Å; W160-L190 HydrophobicContact CD2-CB 4.04Å; W160-L190 HydrophobicContact CD2-CD2 4.23Å; W160-L190 HydrophobicContact CE3-CD2 4.33Å; W160-L190 HydrophobicContact CG-CB 4.04Å; W160-L190 HydrophobicContact CG-CD2 4.21Å; W160-L190 HydrophobicContact CZ2-CB 4.42Å; E167-L190 HydrophobicContact CB-CD1 4.13Å; E167-L190 HydrophobicContact CB-CD2 4.43Å; A169-L190 WeakPolarHBondContact O-CD1 3.35Å; L190-T192 PolarHBondContact O-N 2.93Å; L190-Y200 HydrophobicContact CD2-CD1 3.71Å; L190-Y200 HydrophobicContact CD2-CE1 3.87Å
191	E	95.4	Very high	95.5	Very high	115 Å²	115	48.8 Å²	48.8	54%	0.537	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	119.1	169	-72.1	-178.6	-174.3	0	0	110	L143 G170	L143-E191 HydrophobicContact CD2-CB 4.29Å; L143-E191 HydrophobicContact CD2-CG 3.3Å; L143-E191 HydrophobicContact CG-CG 4.32Å; G170-E191 PolarHBondContact O-N 2.91Å
192	T	93	Very high	95.5	Very high	24 Å²	24	44.2 Å²	44.2	15%	0.147	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	171.4	-176	-166.7	0	0	0	0	112	N142 L144 L190 P194 Y200	N142-T192 PolarHBondContact N-O 2.83Å; N142-T192 PolarHBondContact O-N 2.78Å; L144-T192 HydrophobicContact CD1-CG2 3.99Å; L144-T192 HydrophobicContact CG-CG2 4.06Å; L190-T192 PolarHBondContact O-N 2.93Å; T192-P194 HydrophobicContact CG2-CG 3.96Å; T192-Y200 HydrophobicContact CG2-CE1 3.69Å; T192-Y200 WeakPolarHBondContact CG2-OH 3.42Å; T192-Y200 PolarHBondContact OG1-OH 2.98Å
193	V	93.1	Very high	95.6	Very high	48 Å²	48	39 Å²	39	29%	0.291	21%	0.213	S	C	.	.			trans	-123.8	86.2	174.9	-177.8	0	0	0	0	107.5	R195	V193-R195 PolarHBondContact O-N 2.77Å
194	P	91.7	Very high	95.6	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.026	21%	0.208	C	C	.	.			trans	-61.6	130.1	-170.6	-23.2	33.4	0	0	0	113.1	L138 Q139 T192 Y200 W217 A219	L138-P194 HydrophobicContact CD2-CB 3.95Å; Q139-P194 PolarHBondContact N-O 3.4Å; T192-P194 HydrophobicContact CG2-CG 3.96Å; P194-Y200 WeakPolarHBondContact CA-OH 3.27Å; P194-Y200 HydrophobicContact CB-CE2 4.22Å; P194-W217 HydrophobicContact CB-CH2 3.81Å; P194-W217 HydrophobicContact CB-CZ3 3.91Å; P194-W217 HydrophobicContact CG-CH2 3.93Å; P194-W217 HydrophobicContact CG-CZ3 4.1Å; P194-A219 HydrophobicContact CB-CB 4Å
195	R	90.4	Very high	95.6	Very high	163 Å²	163	40.1 Å²	40.1	62%	0.615	22%	0.218	S	C	*	.			trans	-108.2	149.8	175.6	-54.2	179.1	176.9	-177.3	0	110.8	V193 G197 E198 A219	V193-R195 PolarHBondContact O-N 2.77Å; R195-G197 PolarHBondContact O-N 2.7Å; R195-E198 HydrophobicContact CB-CG 4.13Å; R195-E198 PolarHBondContact N-OE2 3.37Å; R195-E198 WeakPolarHBondContact O-CB 3.29Å; R195-E198 PolarHBondContact O-N 2.73Å; R195-E198 VanDerWaalsContact O-N 3.12Å; R195-A219 WeakPolarHBondContact O-CB 3.32Å
196	S	89.1	Confident	95.6	Very high	81 Å²	81	37.7 Å²	37.7	57%	0.566	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	126.6	-178.4	-177.1	0	0	0	0	111.1
197	G	89	Confident	95.5	Very high	61 Å²	61	40.7 Å²	40.7	63%	0.629	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.7	-10.4	179.5	0	0	0	0	0	114.8	R195 A219	R195-G197 PolarHBondContact O-N 2.7Å; G197-A219 PolarHBondContact N-O 3.09Å; G197-A219 VanDerWaalsContact N-O 3.12Å
198	E	94	Very high	95.5	Very high	31 Å²	31	39.8 Å²	39.8	15%	0.145	22%	0.222	C	C	.	.			trans	-70.3	142.2	174.4	-69.9	176.9	162.6	0	0	111.8	L162 N163 R195 Y200 A219	L162-E198 HydrophobicContact CD1-CB 3.89Å; L162-E198 HydrophobicContact CD1-CG 4.13Å; N163-E198 WeakPolarHBondContact OD1-CA 3.39Å; R195-E198 HydrophobicContact CB-CG 4.13Å; R195-E198 PolarHBondContact N-OE2 3.37Å; R195-E198 WeakPolarHBondContact O-CB 3.29Å; R195-E198 PolarHBondContact O-N 2.73Å; R195-E198 VanDerWaalsContact O-N 3.12Å; E198-Y200 HydrophobicContact CB-CD2 4.45Å; E198-Y200 HydrophobicContact CB-CE2 3.86Å; E198-Y200 PolarHBondContact OE2-OH 3.36Å; E198-A219 HydrophobicContact CB-CB 4.34Å; E198-A219 PolarHBondContact O-N 2.97Å
199	V	95.7	Very high	95.5	Very high	37 Å²	37	40.7 Å²	40.7	22%	0.224	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	117.7	177.1	-175.4	0	0	0	0	108.8	N163 E216 R218	N163-V199 PolarHBondContact N-O 2.04Å; N163-V199 PolarHBondContact OD1-N 2.94Å; V199-E216 HydrophobicContact CG1-CB 4.31Å; V199-E216 HydrophobicContact CG1-CG 4.11Å; V199-R218 HydrophobicContact CG1-CG 4.21Å; V199-R218 HydrophobicContact CG2-CG 4.09Å
200	Y	96.9	Very high	95.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.4	175.4	-64.6	-99.8	0	0	0	108.9	L144 F161 L162 L190 T192 P194 E198 E216 W217	L144-Y200 HydrophobicContact CD1-CD1 3.41Å; L144-Y200 VanDerWaalsContact CD1-CD1 3.41Å; L144-Y200 HydrophobicContact CD1-CD2 3.72Å; L144-Y200 HydrophobicContact CD1-CE1 3.78Å; L144-Y200 HydrophobicContact CD1-CE2 4.07Å; L144-Y200 HydrophobicContact CD1-CG 3.33Å; F161-Y200 CarbonylContact O-C 3.56Å; F161-Y200 VanDerWaalsContact O-CA 3.28Å; F161-Y200 WeakPolarHBondContact O-CA 3.31Å; L162-Y200 HydrophobicContact CD1-CD1 4.03Å; L162-Y200 HydrophobicContact CD1-CD2 4.25Å; L162-Y200 HydrophobicContact CD1-CE1 3.75Å; L162-Y200 HydrophobicContact CD1-CE2 3.97Å; L162-Y200 HydrophobicContact CD1-CG 4.31Å; L162-Y200 HydrophobicContact CD2-CE1 4.49Å; L162-Y200 HydrophobicContact CG-CE1 4.49Å; L190-Y200 HydrophobicContact CD2-CD1 3.71Å; L190-Y200 HydrophobicContact CD2-CE1 3.87Å; T192-Y200 HydrophobicContact CG2-CE1 3.69Å; T192-Y200 WeakPolarHBondContact CG2-OH 3.42Å; T192-Y200 PolarHBondContact OG1-OH 2.98Å; P194-Y200 WeakPolarHBondContact CA-OH 3.27Å; P194-Y200 HydrophobicContact CB-CE2 4.22Å; E198-Y200 HydrophobicContact CB-CD2 4.45Å; E198-Y200 HydrophobicContact CB-CE2 3.86Å; E198-Y200 PolarHBondContact OE2-OH 3.36Å; Y200-E216 CarbonylContact O-C 3.51Å; Y200-E216 WeakPolarHBondContact O-CA 3.24Å; Y200-W217 AromaticContact CD2-CE3 3.49Å; Y200-W217 HydrophobicContact CD2-CE3 3.49Å; Y200-W217 VanDerWaalsContact CD2-CE3 3.49Å; Y200-W217 AromaticContact CD2-CZ3 3.59Å; Y200-W217 HydrophobicContact CD2-CZ3 3.59Å; Y200-W217 HydrophobicContact CE2-CE3 4.13Å; Y200-W217 AromaticContact CE2-CZ3 3.73Å; Y200-W217 HydrophobicContact CE2-CZ3 3.73Å; Y200-W217 HydrophobicContact CG-CE3 4.12Å; Y200-W217 HydrophobicContact CG-CZ3 4.5Å; Y200-W217 PolarHBondContact N-O 3.13Å; Y200-W217 PolarHBondContact O-N 3.41Å
201	T	98	Very high	95.4	Very high	22 Å²	22	50 Å²	50	14%	0.135	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.4	179.6	-51.1	0	0	0	0	109.7	W160 F161 T214 V215	W160-T201 CarbonylContact C-O 3.54Å; W160-T201 WeakPolarHBondContact CA-O 3.45Å; F161-T201 PolarHBondContact N-O 3.37Å; F161-T201 PolarHBondContact O-N 2.97Å; T201-T214 HydrophobicContact CG2-CG2 4.24Å; T201-V215 WeakPolarHBondContact CA-O 3.41Å
202	C	98.2	Very high	95.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.6	165.5	-179.4	0	0	0	0	108.8	V130 C146 V158 W160 T214 V215	V130-C202 HydrophobicContact CG2-CB 3.62Å; C146-C202 HydrophobicContact CB-CB 3.64Å; C146-C202 WeakPolarHBondContact CB-SG 3.25Å; C146-C202 WeakPolarHBondContact SG-CB 3.37Å; C146-C202 CovalentContact SG-SG 2.02Å; C146-C202 PolarHBondContact SG-SG 3.44Å; V158-C202 VanDerWaalsContact CG1-SG 3.58Å; W160-C202 HydrophobicContact CE3-CB 4.27Å; W160-C202 HydrophobicContact CH2-CB 4.25Å; W160-C202 HydrophobicContact CZ3-CB 4.1Å; C202-T214 WeakPolarHBondContact O-CA 3.36Å; C202-V215 PolarHBondContact N-O 3.48Å; C202-V215 PolarHBondContact O-N 3.09Å
203	Q	98.4	Very high	95.7	Very high	36 Å²	36	48.8 Å²	48.8	17%	0.168	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.3	175.3	179.5	174.4	-30.8	0	0	109.6	V158 R159 F161 E205 P212 L213 T214	V158-Q203 CarbonylContact C-O 3.5Å; V158-Q203 WeakPolarHBondContact CA-O 3.35Å; R159-Q203 PolarHBondContact N-O 2.85Å; R159-Q203 PolarHBondContact O-N 2.96Å; F161-Q203 HydrophobicContact CD2-CB 4.22Å; F161-Q203 HydrophobicContact CE2-CB 3.79Å; F161-Q203 HydrophobicContact CE2-CG 4.49Å; F161-Q203 VanDerWaalsContact CE2-OE1 3.23Å; Q203-E205 PolarHBondContact NE2-OE1 2.89Å; Q203-P212 HydrophobicContact CG-CB 3.69Å; Q203-L213 CarbonylContact C-O 3.55Å; Q203-L213 VanDerWaalsContact CA-O 3.3Å; Q203-L213 WeakPolarHBondContact CA-O 3.49Å; Q203-T214 HydrophobicContact CB-CG2 4.26Å; Q203-T214 HydrophobicContact CG-CG2 4.18Å
204	V	98.5	Very high	95.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.6	-179.7	179.9	0	0	0	0	110	P126 V128 V148 I156 E157 V158 P212 L213	P126-V204 HydrophobicContact CG-CG1 4.01Å; V128-V204 HydrophobicContact CG1-CG2 4.06Å; V128-V204 HydrophobicContact CG2-CB 4.17Å; V128-V204 HydrophobicContact CG2-CG2 3.72Å; V148-V204 HydrophobicContact CG1-CG1 4.06Å; V148-V204 HydrophobicContact CG1-CG2 4.33Å; V148-V204 HydrophobicContact CG2-CG2 3.77Å; I156-V204 HydrophobicContact CD1-CG1 3.71Å; I156-V204 HydrophobicContact CG1-CG1 3.94Å; E157-V204 WeakPolarHBondContact O-CA 3.04Å; V158-V204 HydrophobicContact CG1-CG2 4.25Å; V158-V204 HydrophobicContact CG2-CG2 4.23Å; V204-P212 WeakPolarHBondContact O-CA 3.33Å; V204-L213 HydrophobicContact CB-CB 4.33Å; V204-L213 PolarHBondContact N-O 3.41Å; V204-L213 PolarHBondContact O-N 3.29Å
205	E	98.4	Very high	96.2	Very high	67 Å²	67	52.5 Å²	52.5	31%	0.313	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.5	173.3	-62.2	-177.4	-165.6	0	0	109.3	I156 E157 Q203 P212	I156-E205 WeakPolarHBondContact CG1-O 3.33Å; E157-E205 HydrophobicContact CB-CB 4.29Å; E157-E205 PolarHBondContact N-O 2.85Å; E157-E205 PolarHBondContact O-N 2.79Å; Q203-E205 PolarHBondContact NE2-OE1 2.89Å; E205-P212 HydrophobicContact CG-CB 4Å; E205-P212 HydrophobicContact CG-CG 4.04Å
206	H	98.6	Very high	96.5	Very high	11 Å²	11	49.6 Å²	49.6	5%	0.051	31%	0.306	C	S	.	.			trans	-152.3	141.8	-174.9	-178.5	-101.8	0	0	0	110.7	V124 P126 F151 Y152 P153 S155 I156 S208 V209	V124-H206 PolarHBondContact O-CE1 2.94Å; V124-H206 VanDerWaalsContact O-CE1 3.24Å; P126-H206 HydrophobicContact CG-CB 4.26Å; F151-H206 AromaticContact CD2-CD2 3.82Å; F151-H206 AromaticContact CD2-NE2 3.64Å; Y152-H206 PolarHBondContact O-CE1 2.98Å; P153-H206 PolarHBondContact O-NE2 3.02Å; S155-H206 PolarHBondContact O-CD2 2.65Å; S155-H206 VanDerWaalsContact O-CD2 3.25Å; I156-H206 HydrophobicContact CD1-CB 4.48Å; I156-H206 HydrophobicContact CG1-CB 4.27Å; H206-S208 PolarHBondContact CE1-OG 2.95Å; H206-S208 VanDerWaalsContact ND1-CB 3.32Å; H206-S208 WeakPolarHBondContact ND1-CB 3.38Å; H206-S208 PolarHBondContact ND1-N 2.68Å; H206-S208 PolarHBondContact ND1-OG 2.79Å; H206-S208 PolarHBondContact O-N 2.86Å; H206-V209 HydrophobicContact CB-CG2 4.3Å; H206-V209 WeakPolarHBondContact O-CG2 3.48Å; H206-V209 PolarHBondContact O-N 2.81Å
207	P	97.5	Very high	96.8	Very high	70 Å²	70	48.1 Å²	48.1	46%	0.455	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-10.1	-176	-27.6	36	0	0	0	116.8	P153 S155	P153-P207 HydrophobicContact CG-CG 4.43Å; S155-P207 VanDerWaalsContact O-CD 3.25Å; S155-P207 WeakPolarHBondContact O-CD 3.49Å
208	S	97.6	Very high	97	Very high	20 Å²	20	51.7 Å²	51.7	14%	0.14	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.4	177.1	73.6	0	0	0	0	114.2	V124 Q125 H206	V124-S208 PolarHBondContact O-OG 3.34Å; Q125-S208 VanDerWaalsContact CA-OG 3.25Å; Q125-S208 WeakPolarHBondContact CA-OG 3.4Å; Q125-S208 WeakPolarHBondContact CG-OG 3.36Å; Q125-S208 PolarHBondContact NE2-O 2.72Å; H206-S208 PolarHBondContact CE1-OG 2.95Å; H206-S208 VanDerWaalsContact ND1-CB 3.32Å; H206-S208 WeakPolarHBondContact ND1-CB 3.38Å; H206-S208 PolarHBondContact ND1-N 2.68Å; H206-S208 PolarHBondContact ND1-OG 2.79Å; H206-S208 PolarHBondContact O-N 2.86Å
209	V	96.9	Very high	96.7	Very high	26 Å²	26	50.4 Å²	50.4	16%	0.158	28%	0.277	C	S	.	.			trans	-121.6	142.7	-178.4	-66.5	0	0	0	0	110	Q125 H206 S211 L213	Q125-V209 HydrophobicContact CB-CG1 4.36Å; Q125-V209 HydrophobicContact CG-CG1 3.85Å; H206-V209 HydrophobicContact CB-CG2 4.3Å; H206-V209 WeakPolarHBondContact O-CG2 3.48Å; H206-V209 PolarHBondContact O-N 2.81Å; V209-S211 WeakPolarHBondContact CG2-O 3.18Å; V209-L213 HydrophobicContact CG1-CD1 3.97Å; V209-L213 HydrophobicContact CG1-CD2 4.35Å; V209-L213 HydrophobicContact CG1-CG 4.15Å; V209-L213 HydrophobicContact CG2-CG 4.35Å
210	T	95.7	Very high	96	Very high	156 Å²	156	55.2 Å²	55.2	96%	0.957	29%	0.291	S	S	*	.	S	Bend	trans	-82.7	-25	-177	-46	0	0	0	0	112.6
211	S	96.5	Very high	94.4	Very high	78 Å²	78	57 Å²	57	55%	0.545	30%	0.304	S	S	.	.	S	Bend	trans	-130.4	153.3	176.5	60	0	0	0	0	110.1	V209 L213	V209-S211 WeakPolarHBondContact CG2-O 3.18Å; S211-L213 PolarHBondContact O-N 3.19Å
212	P	97.1	Very high	92.9	Very high	59 Å²	59	61.7 Å²	61.7	38%	0.383	32%	0.324	S	S	.	.			trans	-56.6	136.8	175.9	-22.2	32.2	0	0	0	111.6	Q203 V204 E205	Q203-P212 HydrophobicContact CG-CB 3.69Å; V204-P212 WeakPolarHBondContact O-CA 3.33Å; E205-P212 HydrophobicContact CG-CB 4Å; E205-P212 HydrophobicContact CG-CG 4.04Å
213	L	97.4	Very high	91.2	Very high	54 Å²	54	64.4 Å²	64.4	28%	0.283	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.1	173.7	-65.6	170.9	0	0	0	109.1	P126 V128 Q203 V204 V209 S211	P126-L213 HydrophobicContact CG-CD1 3.74Å; V128-L213 HydrophobicContact CG2-CD1 4.26Å; Q203-L213 CarbonylContact C-O 3.55Å; Q203-L213 VanDerWaalsContact CA-O 3.3Å; Q203-L213 WeakPolarHBondContact CA-O 3.49Å; V204-L213 HydrophobicContact CB-CB 4.33Å; V204-L213 PolarHBondContact N-O 3.41Å; V204-L213 PolarHBondContact O-N 3.29Å; V209-L213 HydrophobicContact CG1-CD1 3.97Å; V209-L213 HydrophobicContact CG1-CD2 4.35Å; V209-L213 HydrophobicContact CG1-CG 4.15Å; V209-L213 HydrophobicContact CG2-CG 4.35Å; S211-L213 PolarHBondContact O-N 3.19Å
214	T	97.7	Very high	89.6	Confident	86 Å²	86	64.7 Å²	64.7	53%	0.528	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.1	-179.7	56	0	0	0	0	111.1	T201 C202 Q203	T201-T214 HydrophobicContact CG2-CG2 4.24Å; C202-T214 WeakPolarHBondContact O-CA 3.36Å; Q203-T214 HydrophobicContact CB-CG2 4.26Å; Q203-T214 HydrophobicContact CG-CG2 4.18Å
215	V	97.8	Very high	88.1	Confident	45 Å²	45	70.3 Å²	70.3	27%	0.273	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	122	174	-179.4	0	0	0	0	109.4	V128 V130 T201 C202	V128-V215 HydrophobicContact CB-CG2 3.77Å; V128-V215 HydrophobicContact CG1-CB 4.12Å; V128-V215 HydrophobicContact CG1-CG2 3.59Å; V130-V215 HydrophobicContact CB-CG1 4.06Å; V130-V215 HydrophobicContact CG2-CB 3.9Å; V130-V215 HydrophobicContact CG2-CG1 3.71Å; T201-V215 WeakPolarHBondContact CA-O 3.41Å; C202-V215 PolarHBondContact N-O 3.48Å; C202-V215 PolarHBondContact O-N 3.09Å
216	E	96.9	Very high	86.7	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	143.5	179.3	-69.1	-176.9	-169.5	0	0	112.4	V199 Y200 R218	V199-E216 HydrophobicContact CG1-CB 4.31Å; V199-E216 HydrophobicContact CG1-CG 4.11Å; Y200-E216 CarbonylContact O-C 3.51Å; Y200-E216 WeakPolarHBondContact O-CA 3.24Å; E216-R218 IonicContact OE2-CZ 3.39Å; E216-R218 IonicContact OE2-NE 3.11Å; E216-R218 PolarHBondContact OE2-NE 3.24Å; E216-R218 VanDerWaalsContact OE2-NE 3.13Å; E216-R218 IonicContact OE2-NH2 2.77Å; E216-R218 PolarHBondContact OE2-NH2 2.76Å
217	W	95	Very high	85.7	Confident	49 Å²	49	76.8 Å²	76.8	19%	0.186	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	126.7	164.1	-179.7	90.7	0	0	0	109.2	V130 L144 P194 Y200 A219	V130-W217 HydrophobicContact CB-CB 4.37Å; V130-W217 HydrophobicContact CG1-CB 3.56Å; V130-W217 HydrophobicContact CG1-CG 4.18Å; L144-W217 HydrophobicContact CD1-CD2 4.29Å; L144-W217 HydrophobicContact CD1-CE3 3.59Å; L144-W217 HydrophobicContact CD1-CZ3 3.8Å; L144-W217 HydrophobicContact CD2-CD2 3.73Å; L144-W217 HydrophobicContact CD2-CE3 3.71Å; L144-W217 HydrophobicContact CD2-CG 4.42Å; L144-W217 HydrophobicContact CD2-CH2 3.92Å; L144-W217 HydrophobicContact CD2-CZ2 3.93Å; L144-W217 HydrophobicContact CD2-CZ3 3.8Å; L144-W217 HydrophobicContact CG-CE3 4.32Å; L144-W217 HydrophobicContact CG-CZ3 4.4Å; P194-W217 HydrophobicContact CB-CH2 3.81Å; P194-W217 HydrophobicContact CB-CZ3 3.91Å; P194-W217 HydrophobicContact CG-CH2 3.93Å; P194-W217 HydrophobicContact CG-CZ3 4.1Å; Y200-W217 AromaticContact CD2-CE3 3.49Å; Y200-W217 HydrophobicContact CD2-CE3 3.49Å; Y200-W217 VanDerWaalsContact CD2-CE3 3.49Å; Y200-W217 AromaticContact CD2-CZ3 3.59Å; Y200-W217 HydrophobicContact CD2-CZ3 3.59Å; Y200-W217 HydrophobicContact CE2-CE3 4.13Å; Y200-W217 AromaticContact CE2-CZ3 3.73Å; Y200-W217 HydrophobicContact CE2-CZ3 3.73Å; Y200-W217 HydrophobicContact CG-CE3 4.12Å; Y200-W217 HydrophobicContact CG-CZ3 4.5Å; Y200-W217 PolarHBondContact N-O 3.13Å; Y200-W217 PolarHBondContact O-N 3.41Å; W217-A219 HydrophobicContact CH2-CB 4.03Å; W217-A219 HydrophobicContact CZ3-CB 3.83Å
218	R	93.1	Very high	84.6	Confident	137 Å²	137	78.9 Å²	78.9	52%	0.517	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.3	-176.6	-59.2	-169.3	-174.1	159.4	2.3	110.4	V199 E216 R220	V199-R218 HydrophobicContact CG1-CG 4.21Å; V199-R218 HydrophobicContact CG2-CG 4.09Å; E216-R218 IonicContact OE2-CZ 3.39Å; E216-R218 IonicContact OE2-NE 3.11Å; E216-R218 PolarHBondContact OE2-NE 3.24Å; E216-R218 VanDerWaalsContact OE2-NE 3.13Å; E216-R218 IonicContact OE2-NH2 2.77Å; E216-R218 PolarHBondContact OE2-NH2 2.76Å; R218-R220 PolarHBondContact O-N 3.18Å
219	A	88.3	Confident	83.7	Confident	4 Å²	4	84.2 Å²	84.2	3%	0.033	45%	0.445	C	S	.	.			trans	-70.9	94	172.8	0	0	0	0	0	109.9	L138 P194 R195 G197 E198 W217	L138-A219 HydrophobicContact CD1-CB 4.48Å; L138-A219 HydrophobicContact CD2-CB 3.92Å; P194-A219 HydrophobicContact CB-CB 4Å; R195-A219 WeakPolarHBondContact O-CB 3.32Å; G197-A219 PolarHBondContact N-O 3.09Å; G197-A219 VanDerWaalsContact N-O 3.12Å; E198-A219 HydrophobicContact CB-CB 4.34Å; E198-A219 PolarHBondContact O-N 2.97Å; W217-A219 HydrophobicContact CH2-CB 4.03Å; W217-A219 HydrophobicContact CZ3-CB 3.83Å
220	R	80.7	Confident	83	Confident	138 Å²	138	87.2 Å²	87.2	52%	0.521	47%	0.467	S	S	.	.			trans	-93.1	133.3	174.9	-64.5	-177.3	-174.8	-179.5	3	109.4	R218	R218-R220 PolarHBondContact O-N 3.18Å
221	S	64.2	Low	82.4	Confident	37 Å²	37	81.9 Å²	81.9	26%	0.259	44%	0.443	S	S	.	.			trans	-65	150.8	174.3	72.6	0	0	0	0	110.8	S223 A224 Q225	S221-S223 PolarHBondContact O-N 3.44Å; S221-A224 WeakPolarHBondContact O-CA 3.22Å; S221-A224 WeakPolarHBondContact O-CB 3.45Å; S221-A224 PolarHBondContact O-N 2.98Å; S221-A224 PolarHBondContact OG-N 2.73Å; S221-A224 VanDerWaalsContact OG-N 3.16Å; S221-Q225 PolarHBondContact O-N 3.38Å; S221-Q225 VanDerWaalsContact O-N 3.1Å
222	E	66.9	Low	82	Confident	121 Å²	121	82.1 Å²	82.1	57%	0.565	44%	0.441	S	S	*	.	H	α-helix	trans	-55.2	-33.1	172.5	-68.8	-172.8	165.9	0	0	111.4	P137 A224 Q225 S226	P137-E222 WeakPolarHBondContact CB-OE1 3.4Å; E222-A224 VanDerWaalsContact C-N 3.34Å; E222-A224 PolarHBondContact O-N 3.12Å; E222-Q225 PolarHBondContact O-N 2.97Å; E222-S226 WeakPolarHBondContact O-CB 3.41Å; E222-S226 PolarHBondContact O-N 3.21Å; E222-S226 PolarHBondContact O-OG 3.34Å; E222-S226 VanDerWaalsContact O-OG 3.08Å
223	S	62.1	Low	81.4	Confident	56 Å²	56	80.9 Å²	80.9	39%	0.392	44%	0.439	S	S	.	.	H	α-helix	trans	-61.7	-39.2	173.1	-174.1	0	0	0	0	112.4	S221 S226 K227	S221-S223 PolarHBondContact O-N 3.44Å; S223-S226 WeakPolarHBondContact CA-OG 3.09Å; S223-S226 PolarHBondContact O-OG 3.05Å; S223-S226 VanDerWaalsContact O-OG 3.11Å; S223-K227 WeakPolarHBondContact O-CB 3.44Å; S223-K227 WeakPolarHBondContact O-CD 3.4Å; S223-K227 WeakPolarHBondContact O-CG 3.48Å; S223-K227 PolarHBondContact O-N 2.89Å; S223-K227 WeakPolarHBondContact OG-CE 3.47Å; S223-K227 PolarHBondContact OG-NZ 3.18Å
224	A	64	Low	81.1	Confident	43 Å²	43	80.4 Å²	80.4	36%	0.355	45%	0.447	S	S	.	.	H	α-helix	trans	-70.1	-41.7	177.1	0	0	0	0	0	111.6	S221 E222 M228	S221-A224 WeakPolarHBondContact O-CA 3.22Å; S221-A224 WeakPolarHBondContact O-CB 3.45Å; S221-A224 PolarHBondContact O-N 2.98Å; S221-A224 PolarHBondContact OG-N 2.73Å; S221-A224 VanDerWaalsContact OG-N 3.16Å; E222-A224 VanDerWaalsContact C-N 3.34Å; E222-A224 PolarHBondContact O-N 3.12Å; A224-M228 WeakPolarHBondContact O-CB 3.47Å; A224-M228 PolarHBondContact O-N 3.38Å
225	Q	67	Low	80.7	Confident	118 Å²	118	83.1 Å²	83.1	55%	0.551	45%	0.452	S	S	*	.	H	α-helix	trans	-64	-44.7	174.7	-93.1	-177.9	-32	0	0	112.1	S221 E222 M228 L229	S221-Q225 PolarHBondContact O-N 3.38Å; S221-Q225 VanDerWaalsContact O-N 3.1Å; E222-Q225 PolarHBondContact O-N 2.97Å; Q225-M228 PolarHBondContact O-N 2.86Å; Q225-L229 PolarHBondContact O-N 2.88Å
226	S	69.5	Low	80.5	Confident	69 Å²	69	84.6 Å²	84.6	48%	0.483	46%	0.461	S	S	.	.	H	α-helix	trans	-67.6	-39.7	179.6	67.1	0	0	0	0	112.3	E222 S223 L229 S230	E222-S226 WeakPolarHBondContact O-CB 3.41Å; E222-S226 PolarHBondContact O-N 3.21Å; E222-S226 PolarHBondContact O-OG 3.34Å; E222-S226 VanDerWaalsContact O-OG 3.08Å; S223-S226 WeakPolarHBondContact CA-OG 3.09Å; S223-S226 PolarHBondContact O-OG 3.05Å; S223-S226 VanDerWaalsContact O-OG 3.11Å; S226-L229 PolarHBondContact O-N 3.05Å; S226-S230 VanDerWaalsContact O-CB 3.3Å; S226-S230 WeakPolarHBondContact O-CB 3.24Å; S226-S230 PolarHBondContact O-N 2.81Å
227	K	78.3	Confident	80.4	Confident	145 Å²	145	84.5 Å²	84.5	63%	0.63	46%	0.463	S	S	*	.	H	α-helix	trans	-63.2	-40.8	172.6	-76.4	171.8	180	171.3	0	111.8	S223 S230 G231	S223-K227 WeakPolarHBondContact O-CB 3.44Å; S223-K227 WeakPolarHBondContact O-CD 3.4Å; S223-K227 WeakPolarHBondContact O-CG 3.48Å; S223-K227 PolarHBondContact O-N 2.89Å; S223-K227 WeakPolarHBondContact OG-CE 3.47Å; S223-K227 PolarHBondContact OG-NZ 3.18Å; K227-S230 PolarHBondContact O-N 3.26Å; K227-G231 PolarHBondContact O-N 3.04Å
228	M	74.4	Confident	80.2	Confident	113 Å²	113	83.7 Å²	83.7	56%	0.557	47%	0.47	S	S	*	.	H	α-helix	trans	-65.7	-43.5	176.6	-159.9	-177.7	109.3	0	0	111.1	A224 Q225 G231 V232	A224-M228 WeakPolarHBondContact O-CB 3.47Å; A224-M228 PolarHBondContact O-N 3.38Å; Q225-M228 PolarHBondContact O-N 2.86Å; M228-G231 PolarHBondContact O-N 3.34Å; M228-V232 WeakPolarHBondContact O-CG2 3.48Å; M228-V232 PolarHBondContact O-N 2.65Å
229	L	78	Confident	80.3	Confident	132 Å²	132	81.6 Å²	81.6	69%	0.691	47%	0.468	S	S	*	.	H	α-helix	trans	-63.5	-43.1	175.9	-115.3	93.8	0	0	0	112.4	Q225 S226 G231 V232 G233	Q225-L229 PolarHBondContact O-N 2.88Å; S226-L229 PolarHBondContact O-N 3.05Å; L229-G231 VanDerWaalsContact C-N 3.33Å; L229-V232 PolarHBondContact O-N 2.84Å; L229-G233 PolarHBondContact O-N 3.41Å
230	S	82	Confident	80.6	Confident	90 Å²	90	87 Å²	87	63%	0.629	50%	0.496	S	S	*	.	H	α-helix	trans	-63.4	-40.6	176.1	-179.4	0	0	0	0	111.3	S226 K227 G233 G234	S226-S230 VanDerWaalsContact O-CB 3.3Å; S226-S230 WeakPolarHBondContact O-CB 3.24Å; S226-S230 PolarHBondContact O-N 2.81Å; K227-S230 PolarHBondContact O-N 3.26Å; S230-G233 PolarHBondContact O-N 2.64Å; S230-G234 PolarHBondContact O-N 2.83Å
231	G	83.5	Confident	81.2	Confident	44 Å²	44	87.7 Å²	87.7	45%	0.454	50%	0.503	S	S	.	.	H	α-helix	trans	-64	-44	174.8	0	0	0	0	0	113.1	K227 M228 L229 G234 F235	K227-G231 PolarHBondContact O-N 3.04Å; M228-G231 PolarHBondContact O-N 3.34Å; L229-G231 VanDerWaalsContact C-N 3.33Å; G231-G234 PolarHBondContact O-N 3.14Å; G231-F235 WeakPolarHBondContact O-CB 3.14Å; G231-F235 PolarHBondContact O-N 3.4Å
232	V	88.4	Confident	82.7	Confident	83 Å²	83	91.3 Å²	91.3	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-45.4	174.4	172.1	0	0	0	0	110.5	M228 L229 G234 F235 V236	M228-V232 WeakPolarHBondContact O-CG2 3.48Å; M228-V232 PolarHBondContact O-N 2.65Å; L229-V232 PolarHBondContact O-N 2.84Å; V232-G234 PolarHBondContact O-N 2.79Å; V232-F235 PolarHBondContact O-N 2.94Å; V232-V236 HydrophobicContact CG1-CG2 4.45Å; V232-V236 WeakPolarHBondContact O-CG2 3.29Å; V232-V236 PolarHBondContact O-N 3.09Å
233	G	85.2	Confident	83.9	Confident	33 Å²	33	87.4 Å²	87.4	34%	0.34	51%	0.512	S	S	.	.	H	α-helix	trans	-58.4	-46.6	175.7	0	0	0	0	0	112.5	L229 S230 V236 L237	L229-G233 PolarHBondContact O-N 3.41Å; S230-G233 PolarHBondContact O-N 2.64Å; G233-V236 PolarHBondContact O-N 3.48Å; G233-L237 WeakPolarHBondContact O-CB 3.49Å; G233-L237 WeakPolarHBondContact O-CD1 3.25Å; G233-L237 PolarHBondContact O-N 2.97Å
234	G	89.6	Confident	85.4	Confident	43 Å²	43	87 Å²	87	44%	0.443	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-40	176.6	0	0	0	0	0	113.3	S230 G231 V232 L237 G238	S230-G234 PolarHBondContact O-N 2.83Å; G231-G234 PolarHBondContact O-N 3.14Å; V232-G234 PolarHBondContact O-N 2.79Å; G234-L237 PolarHBondContact O-N 2.93Å; G234-G238 PolarHBondContact O-N 3.32Å
235	F	90.9	Very high	86.7	Confident	143 Å²	143	86.9 Å²	86.9	63%	0.627	52%	0.515	S	S	*	.	H	α-helix	trans	-66.2	-43.1	177.5	-175.7	-103.1	0	0	0	112.1	G231 V232 G238 L239	G231-F235 WeakPolarHBondContact O-CB 3.14Å; G231-F235 PolarHBondContact O-N 3.4Å; V232-F235 PolarHBondContact O-N 2.94Å; F235-G238 PolarHBondContact O-N 3.41Å; F235-L239 HydrophobicContact CD1-CD1 3.91Å; F235-L239 HydrophobicContact CD1-CG 4.4Å; F235-L239 HydrophobicContact CE1-CD1 3.38Å; F235-L239 HydrophobicContact CE1-CG 4.03Å; F235-L239 HydrophobicContact CZ-CD1 3.86Å; F235-L239 HydrophobicContact CZ-CD2 4.35Å; F235-L239 HydrophobicContact CZ-CG 4.14Å; F235-L239 PolarHBondContact O-N 2.9Å
236	V	92.3	Very high	88	Confident	77 Å²	77	85.4 Å²	85.4	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-45.1	176	173.2	0	0	0	0	110.8	V232 G233 G238 L239 L240	V232-V236 HydrophobicContact CG1-CG2 4.45Å; V232-V236 WeakPolarHBondContact O-CG2 3.29Å; V232-V236 PolarHBondContact O-N 3.09Å; G233-V236 PolarHBondContact O-N 3.48Å; V236-G238 VanDerWaalsContact C-N 3.34Å; V236-G238 PolarHBondContact O-N 3.31Å; V236-L239 PolarHBondContact O-N 3.39Å; V236-L240 HydrophobicContact CG1-CD1 4.41Å; V236-L240 WeakPolarHBondContact O-CG 3.44Å; V236-L240 PolarHBondContact O-N 2.55Å; V236-L240 VanDerWaalsContact O-N 3.08Å
237	L	94.2	Very high	88.9	Confident	99 Å²	99	88.7 Å²	88.7	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-58.9	-44.9	173.3	-84.1	153.8	0	0	0	111.5	G233 G234 L239 L240 F241	G233-L237 WeakPolarHBondContact O-CB 3.49Å; G233-L237 WeakPolarHBondContact O-CD1 3.25Å; G233-L237 PolarHBondContact O-N 2.97Å; G234-L237 PolarHBondContact O-N 2.93Å; L237-L239 PolarHBondContact O-N 3.05Å; L237-L240 WeakPolarHBondContact O-CB 3.26Å; L237-L240 PolarHBondContact O-N 2.83Å; L237-F241 HydrophobicContact CD2-CE2 4.28Å; L237-F241 WeakPolarHBondContact O-CD2 3.49Å; L237-F241 PolarHBondContact O-N 2.95Å
238	G	92.4	Very high	89.5	Confident	32 Å²	32	86.6 Å²	86.6	33%	0.33	51%	0.51	S	S	.	.	H	α-helix	trans	-59.7	-44.1	177.5	0	0	0	0	0	113.2	G234 F235 V236 L240 F241 L242	G234-G238 PolarHBondContact O-N 3.32Å; F235-G238 PolarHBondContact O-N 3.41Å; V236-G238 VanDerWaalsContact C-N 3.34Å; V236-G238 PolarHBondContact O-N 3.31Å; G238-L240 VanDerWaalsContact C-N 3.35Å; G238-L240 PolarHBondContact O-N 3.27Å; G238-F241 PolarHBondContact O-N 3.45Å; G238-L242 WeakPolarHBondContact O-CB 3.39Å; G238-L242 PolarHBondContact O-N 3.38Å
239	L	95.4	Very high	90.1	Very high	93 Å²	93	87.5 Å²	87.5	49%	0.487	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-37.6	175.8	-75.1	178.8	0	0	0	112.6	F235 V236 L237 L242 G243	F235-L239 HydrophobicContact CD1-CD1 3.91Å; F235-L239 HydrophobicContact CD1-CG 4.4Å; F235-L239 HydrophobicContact CE1-CD1 3.38Å; F235-L239 HydrophobicContact CE1-CG 4.03Å; F235-L239 HydrophobicContact CZ-CD1 3.86Å; F235-L239 HydrophobicContact CZ-CD2 4.35Å; F235-L239 HydrophobicContact CZ-CG 4.14Å; F235-L239 PolarHBondContact O-N 2.9Å; V236-L239 PolarHBondContact O-N 3.39Å; L237-L239 PolarHBondContact O-N 3.05Å; L239-L242 PolarHBondContact O-N 3.46Å; L239-G243 PolarHBondContact O-N 3.49Å
240	L	94.4	Very high	90.5	Very high	118 Å²	118	86.8 Å²	86.8	62%	0.618	50%	0.5	S	S	*	.	H	α-helix	trans	-63	-44.9	174.9	-71	170.7	0	0	0	111.5	V236 L237 G238 G243 A244	V236-L240 HydrophobicContact CG1-CD1 4.41Å; V236-L240 WeakPolarHBondContact O-CG 3.44Å; V236-L240 PolarHBondContact O-N 2.55Å; V236-L240 VanDerWaalsContact O-N 3.08Å; L237-L240 WeakPolarHBondContact O-CB 3.26Å; L237-L240 PolarHBondContact O-N 2.83Å; G238-L240 VanDerWaalsContact C-N 3.35Å; G238-L240 PolarHBondContact O-N 3.27Å; L240-G243 PolarHBondContact O-N 3.13Å; L240-A244 WeakPolarHBondContact O-CB 3.33Å; L240-A244 PolarHBondContact O-N 2.67Å
241	F	93.7	Very high	90.7	Very high	153 Å²	153	91.1 Å²	91.1	67%	0.671	50%	0.503	S	S	*	.	H	α-helix	trans	-67.3	-39.1	176.4	-76.8	-67.9	0	0	0	112.7	L237 G238 A244 G245	L237-F241 HydrophobicContact CD2-CE2 4.28Å; L237-F241 WeakPolarHBondContact O-CD2 3.49Å; L237-F241 PolarHBondContact O-N 2.95Å; G238-F241 PolarHBondContact O-N 3.45Å; F241-A244 PolarHBondContact O-N 3.42Å; F241-G245 PolarHBondContact O-N 3.02Å
242	L	94.2	Very high	90.5	Very high	112 Å²	112	94.1 Å²	94.1	59%	0.586	51%	0.508	S	S	*	.	H	α-helix	trans	-62.1	-45.3	173.7	-104.1	153.7	0	0	0	111.6	G238 L239 G245 L246	G238-L242 WeakPolarHBondContact O-CB 3.39Å; G238-L242 PolarHBondContact O-N 3.38Å; L239-L242 PolarHBondContact O-N 3.46Å; L242-G245 PolarHBondContact O-N 3.44Å; L242-L246 HydrophobicContact CD2-CD1 4.39Å; L242-L246 WeakPolarHBondContact O-CB 3.18Å; L242-L246 PolarHBondContact O-N 2.94Å
243	G	92.7	Very high	89.8	Confident	40 Å²	40	95.1 Å²	95.1	41%	0.412	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-45.5	175.8	0	0	0	0	0	112.3	L239 L240 F247	L239-G243 PolarHBondContact O-N 3.49Å; L240-G243 PolarHBondContact O-N 3.13Å; G243-F247 VanDerWaalsContact O-CB 3.31Å; G243-F247 WeakPolarHBondContact O-CB 3.31Å; G243-F247 PolarHBondContact O-N 2.65Å
244	A	93.3	Very high	88.7	Confident	48 Å²	48	102.3 Å²	102.3	40%	0.397	53%	0.529	S	S	.	.	H	α-helix	trans	-63.5	-42.4	175.3	0	0	0	0	0	112.3	L240 F241 F247 I248	L240-A244 WeakPolarHBondContact O-CB 3.33Å; L240-A244 PolarHBondContact O-N 2.67Å; F241-A244 PolarHBondContact O-N 3.42Å; A244-F247 PolarHBondContact O-N 2.95Å; A244-I248 VanDerWaalsContact O-CG1 3.31Å; A244-I248 WeakPolarHBondContact O-CG1 3.46Å; A244-I248 PolarHBondContact O-N 3.12Å
245	G	91.9	Very high	87.1	Confident	40 Å²	40	102.9 Å²	102.9	41%	0.412	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-46.6	177.8	0	0	0	0	0	112.8	F241 L242 F247 I248 Y249	F241-G245 PolarHBondContact O-N 3.02Å; L242-G245 PolarHBondContact O-N 3.44Å; G245-F247 VanDerWaalsContact C-N 3.34Å; G245-F247 PolarHBondContact O-N 2.86Å; G245-I248 PolarHBondContact O-N 3Å; G245-Y249 WeakPolarHBondContact O-CB 3.48Å; G245-Y249 PolarHBondContact O-N 3.49Å
246	L	92.7	Very high	85.4	Confident	87 Å²	87	104.8 Å²	104.8	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-60.4	-43.4	173.7	-83.6	156.1	0	0	0	111.2	L242 I248 Y249 F250	L242-L246 HydrophobicContact CD2-CD1 4.39Å; L242-L246 WeakPolarHBondContact O-CB 3.18Å; L242-L246 PolarHBondContact O-N 2.94Å; L246-I248 PolarHBondContact O-N 2.95Å; L246-Y249 PolarHBondContact O-N 2.88Å; L246-F250 HydrophobicContact CB-CD2 4.46Å; L246-F250 HydrophobicContact CB-CE2 4.43Å; L246-F250 HydrophobicContact CD2-CD2 4.44Å; L246-F250 HydrophobicContact CD2-CE2 3.74Å; L246-F250 HydrophobicContact CD2-CZ 4.44Å; L246-F250 WeakPolarHBondContact O-CD2 3.27Å; L246-F250 PolarHBondContact O-N 3.01Å
247	F	89.9	Confident	83.4	Confident	138 Å²	138	106.6 Å²	106.6	61%	0.605	56%	0.562	S	S	*	*	H	α-helix	trans	-59.6	-46.1	177	-178.8	-98.6	0	0	0	112.1	G243 A244 G245 R251	G243-F247 VanDerWaalsContact O-CB 3.31Å; G243-F247 WeakPolarHBondContact O-CB 3.31Å; G243-F247 PolarHBondContact O-N 2.65Å; A244-F247 PolarHBondContact O-N 2.95Å; G245-F247 VanDerWaalsContact C-N 3.34Å; G245-F247 PolarHBondContact O-N 2.86Å; F247-R251 WeakPolarHBondContact O-CB 3.34Å; F247-R251 PolarHBondContact O-N 2.71Å
248	I	89.6	Confident	81.2	Confident	100 Å²	100	104.5 Å²	104.5	51%	0.513	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-43.8	177.1	-66.1	167.3	0	0	0	111	A244 G245 L246 F250 R251 N252	A244-I248 VanDerWaalsContact O-CG1 3.31Å; A244-I248 WeakPolarHBondContact O-CG1 3.46Å; A244-I248 PolarHBondContact O-N 3.12Å; G245-I248 PolarHBondContact O-N 3Å; L246-I248 PolarHBondContact O-N 2.95Å; I248-F250 PolarHBondContact O-N 3.38Å; I248-R251 WeakPolarHBondContact O-CB 3.35Å; I248-R251 PolarHBondContact O-N 3.02Å; I248-N252 PolarHBondContact O-N 3.05Å
249	Y	88.3	Confident	79.1	Confident	133 Å²	133	111.1 Å²	111.1	52%	0.522	59%	0.591	S	S	.	*	H	α-helix	trans	-58.8	-48.8	178.5	177.6	-97.4	0	0	0	112.1	G245 L246 R251 N252 Q253	G245-Y249 WeakPolarHBondContact O-CB 3.48Å; G245-Y249 PolarHBondContact O-N 3.49Å; L246-Y249 PolarHBondContact O-N 2.88Å; Y249-R251 VanDerWaalsContact C-N 3.3Å; Y249-R251 PolarHBondContact O-N 3.39Å; Y249-N252 PolarHBondContact O-N 3.48Å; Y249-Q253 HydrophobicContact CE1-CG 4.36Å; Y249-Q253 PolarHBondContact O-N 3.03Å; Y249-Q253 PolarHBondContact OH-NE2 3.45Å
250	F	85.2	Confident	76.7	Confident	116 Å²	116	115.5 Å²	115.5	51%	0.509	61%	0.609	S	S	.	*	H	α-helix	trans	-66.3	-31	177	-76.5	-60.3	0	0	0	112.8	L246 I248 K254	L246-F250 HydrophobicContact CB-CD2 4.46Å; L246-F250 HydrophobicContact CB-CE2 4.43Å; L246-F250 HydrophobicContact CD2-CD2 4.44Å; L246-F250 HydrophobicContact CD2-CE2 3.74Å; L246-F250 HydrophobicContact CD2-CZ 4.44Å; L246-F250 WeakPolarHBondContact O-CD2 3.27Å; L246-F250 PolarHBondContact O-N 3.01Å; I248-F250 PolarHBondContact O-N 3.38Å; F250-K254 PolarHBondContact O-N 3.02Å
251	R	86.2	Confident	74.7	Confident	182 Å²	182	115.1 Å²	115.1	69%	0.687	61%	0.613	S	S	*	*	H	α-helix	trans	-65.9	-40.4	172.6	-127.8	-177.8	91.1	146.1	4.7	111.9	F247 I248 Y249 K254	F247-R251 WeakPolarHBondContact O-CB 3.34Å; F247-R251 PolarHBondContact O-N 2.71Å; I248-R251 WeakPolarHBondContact O-CB 3.35Å; I248-R251 PolarHBondContact O-N 3.02Å; Y249-R251 VanDerWaalsContact C-N 3.3Å; Y249-R251 PolarHBondContact O-N 3.39Å; R251-K254 PolarHBondContact O-N 3.22Å
252	N	80.1	Confident	72.5	Confident	107 Å²	107	114 Å²	114	57%	0.572	62%	0.62	S	S	*	*	H	α-helix	trans	-72.3	-37.7	-179.7	-79.1	-7.7	0	0	0	112.9	I248 Y249 K254 G255	I248-N252 PolarHBondContact O-N 3.05Å; Y249-N252 PolarHBondContact O-N 3.48Å; N252-K254 VanDerWaalsContact C-N 3.26Å; N252-K254 PolarHBondContact O-N 3.18Å; N252-G255 PolarHBondContact O-N 2.96Å
253	Q	74.2	Confident	70.6	Confident	104 Å²	104	112.3 Å²	112.3	49%	0.486	63%	0.629	S	S	.	*	H	α-helix	trans	-61.8	-35.2	174.4	-89.7	-167.7	-17.3	0	0	112.6	Y249 G255	Y249-Q253 HydrophobicContact CE1-CG 4.36Å; Y249-Q253 PolarHBondContact O-N 3.03Å; Y249-Q253 PolarHBondContact OH-NE2 3.45Å; Q253-G255 PolarHBondContact O-N 2.85Å
254	K	60.7	Low	68.8	Low	184 Å²	184	120.5 Å²	120.5	80%	0.8	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-14.8	174	-73.2	-177.8	178.4	-178.9	0	113.5	F250 R251 N252	F250-K254 PolarHBondContact O-N 3.02Å; R251-K254 PolarHBondContact O-N 3.22Å; N252-K254 VanDerWaalsContact C-N 3.26Å; N252-K254 PolarHBondContact O-N 3.18Å
255	G	57.7	Low	66.9	Low	55 Å²	55	126.8 Å²	126.8	57%	0.567	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-15	-179.9	0	0	0	0	0	116.1	N252 Q253	N252-G255 PolarHBondContact O-N 2.96Å; Q253-G255 PolarHBondContact O-N 2.85Å
256	H	53.4	Low	64.8	Low	182 Å²	182	133.7 Å²	133.7	84%	0.843	72%	0.721	S	S	*	*	S	Bend	trans	-97.4	8.1	-177	-93.3	64.8	0	0	0	114.7
257	S	51.7	Low	63.4	Low	116 Å²	116	136 Å²	136	81%	0.811	74%	0.735	S	S	*	*	S	Bend	trans	-97.7	24.7	179.8	-56.9	0	0	0	0	114.2
258	G	47.9	Very low	62	Low	54 Å²	54	135.9 Å²	135.9	56%	0.557	74%	0.741	S	S	*	*	S	Bend	trans	-164.3	93.9	176.9	0	0	0	0	0	114.3
259	L	47.2	Very low	60.5	Low	171 Å²	171	137.9 Å²	137.9	90%	0.895	75%	0.754	S	S	*	*			trans	171.6	106	146.3	-99.3	145.5	0	0	0	109.9
260	Q	46.7	Very low	58.8	Low	185 Å²	185	138.2 Å²	138.2	86%	0.864	77%	0.768	S	S	*	*			trans	-114.9	115.7	164.6	-166.2	-171.7	-3.3	0	0	107.2
261	P	51.3	Low	57.2	Low	110 Å²	110	139.6 Å²	139.6	71%	0.714	78%	0.784	S	S	*	*			trans	-112.4	118.4	161.5	16.6	2.8	0	0	0	110.1
262	T	48.6	Very low	55.2	Low	131 Å²	131	136.7 Å²	136.7	80%	0.804	79%	0.791	S	S	*	*			trans	-62	122.6	162.7	35.9	0	0	0	0	110.4
263	G	52.6	Low	53.5	Low	76 Å²	76	138.9 Å²	138.9	78%	0.784	81%	0.806	S	S	*	*			trans	-124.6	121.3	168.9	0	0	0	0	0	110.5
264	F	55.2	Low	51.9	Low	211 Å²	211	141.5 Å²	141.5	93%	0.925	83%	0.831	S	S	*	*			trans	-63	150.2	178.9	-97.6	-105.6	0	0	0	113.8
265	L	53.5	Low	51.1	Low	180 Å²	180	138 Å²	138	94%	0.942	83%	0.833	S	S	*	*			trans	-101	115.5	156.7	-85.9	164.8	0	0	0	108.8
266	S	47.9	Very low	50.5	Low	185 Å²	185	145.5 Å²	145.5	100%	1.294	86%	0.858	S	S	*	*			trans	-153.9	0	141.9	-172.9	0	0	0	0	108.6

Retrieved 266 of 266 residues in 151.2 ms (Link to these results)

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