A0A024F9R7_HUMAN Loading...

HLA class II histocompatibility antigen DR beta chain

AlphaFold DB , UniProt , Accession A0A024F9R7, 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	41.8	Very low	44.4	Very low	238 Å²	238	135.5 Å²	135.5	100%	1.172	81%	0.806	S	S	*	*				0	93.2	0	-159.3	171.9	-167.4	0	0	107
2	V	27.4	Very low	45.4	Very low	132 Å²	132	136.2 Å²	136.2	80%	0.8	80%	0.798	S	S	*	*			trans	-119.9	103.1	179.5	176.4	0	0	0	0	106.6	L4	V2-L4 PolarHBondContact O-N 3.42Å
3	C	38.5	Very low	46.5	Very low	117 Å²	117	129.5 Å²	129.5	79%	0.791	77%	0.769	S	S	*	*			trans	-76	108.6	166.5	-80.8	0	0	0	0	108.4	R5	C3-R5 PolarHBondContact O-N 3.46Å
4	L	36	Very low	47.7	Very low	154 Å²	154	126.3 Å²	126.3	81%	0.806	75%	0.75	S	S	*	*			trans	-87.1	98.3	159.8	-89.8	153	0	0	0	108	V2 L6	V2-L4 PolarHBondContact O-N 3.42Å; L4-L6 PolarHBondContact O-N 3.4Å
5	R	44.5	Very low	48.8	Very low	241 Å²	241	124.1 Å²	124.1	91%	0.909	73%	0.733	S	S	*	*			trans	-70.3	113.7	162.3	-79.7	-173.7	175	179.1	-0.9	107.8	C3	C3-R5 PolarHBondContact O-N 3.46Å
6	L	42.7	Very low	49.8	Very low	158 Å²	158	120.6 Å²	120.6	83%	0.827	71%	0.713	S	S	*	*			trans	-87.2	132.1	166.5	-78.8	162.3	0	0	0	109.5	L4	L4-L6 PolarHBondContact O-N 3.4Å
7	P	43.2	Very low	50.6	Low	123 Å²	123	118.7 Å²	118.7	80%	0.799	70%	0.703	S	S	*	*			trans	-79	133.5	-176.3	30.1	-30.8	0	0	0	112
8	G	49.3	Very low	51.3	Low	78 Å²	78	115.8 Å²	115.8	80%	0.804	69%	0.686	S	S	*	*			trans	22.4	114.5	149.6	0	0	0	0	0	120.3
9	G	56.6	Low	51.8	Low	73 Å²	73	115.3 Å²	115.3	75%	0.753	68%	0.679	S	S	*	*	S	Bend		111	-14.5	100.9	0	0	0	0	0	118.8
10	S	55.1	Low	52.4	Low	83 Å²	83	116.1 Å²	116.1	58%	0.58	68%	0.678	S	S	*	*	S	Bend	trans	-124.4	-48.4	179.7	174.9	0	0	0	0	113.1	M12 A13 V14	S10-M12 PolarHBondContact O-N 3.01Å; S10-A13 PolarHBondContact O-N 3.24Å; S10-V14 WeakPolarHBondContact O-CG2 3.38Å; S10-V14 PolarHBondContact O-N 3.39Å
11	C	53.1	Low	52.8	Low	93 Å²	93	115.2 Å²	115.2	63%	0.628	67%	0.674	S	S	*	*	H	α-helix	trans	-67.1	-37.8	-174.6	-161.3	0	0	0	0	112.8	V14 L15	C11-V14 PolarHBondContact O-N 3.44Å; C11-L15 WeakPolarHBondContact O-CB 3.42Å; C11-L15 PolarHBondContact O-N 2.88Å
12	M	57	Low	53.5	Low	144 Å²	144	111 Å²	111	71%	0.709	66%	0.655	S	S	*	*	H	α-helix	trans	-67.6	-38	176.6	-71.2	-62.5	-70.5	0	0	112.1	S10 L15 T16	S10-M12 PolarHBondContact O-N 3.01Å; M12-L15 PolarHBondContact O-N 3.5Å; M12-T16 PolarHBondContact O-N 2.85Å; M12-T16 PolarHBondContact O-OG1 3.45Å
13	A	60	Low	54.9	Low	50 Å²	50	108 Å²	108	41%	0.413	64%	0.64	S	S	.	*	H	α-helix	trans	-65.3	-46.1	177	0	0	0	0	0	110.7	S10 L15 T16 V17	S10-A13 PolarHBondContact O-N 3.24Å; A13-L15 PolarHBondContact O-N 2.87Å; A13-T16 VanDerWaalsContact CA-OG1 3.31Å; A13-T16 WeakPolarHBondContact CA-OG1 3.39Å; A13-T16 PolarHBondContact O-N 2.58Å; A13-T16 PolarHBondContact O-OG1 3.27Å; A13-V17 VanDerWaalsContact O-CG2 3.29Å; A13-V17 WeakPolarHBondContact O-CG2 3.31Å; A13-V17 PolarHBondContact O-N 2.79Å
14	V	62.3	Low	55.5	Low	84 Å²	84	105.6 Å²	105.6	51%	0.509	63%	0.625	S	S	.	*	H	α-helix	trans	-60	-45.9	173.7	175.6	0	0	0	0	110.3	S10 C11 T16 V17 T18	S10-V14 WeakPolarHBondContact O-CG2 3.38Å; S10-V14 PolarHBondContact O-N 3.39Å; C11-V14 PolarHBondContact O-N 3.44Å; V14-T16 PolarHBondContact O-N 2.8Å; V14-V17 PolarHBondContact O-N 2.87Å; V14-T18 WeakPolarHBondContact O-CB 3.29Å; V14-T18 PolarHBondContact O-N 3.31Å; V14-T18 PolarHBondContact O-OG1 3.47Å
15	L	64.9	Low	56.5	Low	94 Å²	94	104 Å²	104	49%	0.492	62%	0.624	S	S	.	*	H	α-helix	trans	-61.9	-42.8	177.8	-122.1	105.8	0	0	0	112.2	C11 M12 A13 T18 L19	C11-L15 WeakPolarHBondContact O-CB 3.42Å; C11-L15 PolarHBondContact O-N 2.88Å; M12-L15 PolarHBondContact O-N 3.5Å; A13-L15 PolarHBondContact O-N 2.87Å; L15-T18 PolarHBondContact O-N 3.36Å; L15-L19 HydrophobicContact CD2-CD1 4.29Å; L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 PolarHBondContact O-N 2.81Å
16	T	64.3	Low	57	Low	67 Å²	67	99.7 Å²	99.7	41%	0.411	62%	0.618	S	S	.	*	H	α-helix	trans	-65.5	-40.3	175.6	34.3	0	0	0	0	112.5	M12 A13 V14 L19 M20	M12-T16 PolarHBondContact O-N 2.85Å; M12-T16 PolarHBondContact O-OG1 3.45Å; A13-T16 VanDerWaalsContact CA-OG1 3.31Å; A13-T16 WeakPolarHBondContact CA-OG1 3.39Å; A13-T16 PolarHBondContact O-N 2.58Å; A13-T16 PolarHBondContact O-OG1 3.27Å; V14-T16 PolarHBondContact O-N 2.8Å; T16-L19 PolarHBondContact O-N 3.27Å; T16-M20 WeakPolarHBondContact O-CB 3.4Å; T16-M20 VanDerWaalsContact O-CG 3.25Å; T16-M20 WeakPolarHBondContact O-CG 3.32Å; T16-M20 PolarHBondContact O-N 2.85Å
17	V	63.7	Low	57.7	Low	89 Å²	89	95.9 Å²	95.9	54%	0.539	61%	0.609	S	S	.	*	H	α-helix	trans	-66.8	-42.1	176.3	172.3	0	0	0	0	110.3	A13 V14 M20 V21	A13-V17 VanDerWaalsContact O-CG2 3.29Å; A13-V17 WeakPolarHBondContact O-CG2 3.31Å; A13-V17 PolarHBondContact O-N 2.79Å; V14-V17 PolarHBondContact O-N 2.87Å; V17-M20 PolarHBondContact O-N 3.42Å; V17-V21 HydrophobicContact CG1-CG2 4.35Å; V17-V21 WeakPolarHBondContact O-CB 3.25Å; V17-V21 VanDerWaalsContact O-CG2 3.23Å; V17-V21 WeakPolarHBondContact O-CG2 3.41Å; V17-V21 PolarHBondContact O-N 3.48Å
18	T	63.5	Low	58.3	Low	67 Å²	67	98.1 Å²	98.1	41%	0.411	61%	0.613	S	S	.	*	H	α-helix	trans	-66.1	-40.6	177.7	-38	0	0	0	0	110.8	V14 L15 V21 L22	V14-T18 WeakPolarHBondContact O-CB 3.29Å; V14-T18 PolarHBondContact O-N 3.31Å; V14-T18 PolarHBondContact O-OG1 3.47Å; L15-T18 PolarHBondContact O-N 3.36Å; T18-V21 PolarHBondContact O-N 3.02Å; T18-L22 HydrophobicContact CG2-CD1 3.99Å; T18-L22 VanDerWaalsContact O-CB 3.29Å; T18-L22 WeakPolarHBondContact O-CB 3.17Å; T18-L22 WeakPolarHBondContact O-CD1 3.23Å; T18-L22 WeakPolarHBondContact O-CG 3.36Å; T18-L22 PolarHBondContact O-N 2.97Å
19	L	60.3	Low	58.8	Low	105 Å²	105	98.2 Å²	98.2	55%	0.55	61%	0.606	S	S	.	*	H	α-helix	trans	-63.1	-45.3	172.6	-111	104.2	0	0	0	111	L15 T16 V21 L22 S23	L15-L19 HydrophobicContact CD2-CD1 4.29Å; L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 PolarHBondContact O-N 2.81Å; T16-L19 PolarHBondContact O-N 3.27Å; L19-V21 VanDerWaalsContact C-N 3.34Å; L19-V21 PolarHBondContact O-N 3.17Å; L19-L22 CarbonylContact O-C 3.52Å; L19-L22 PolarHBondContact O-N 2.97Å; L19-S23 WeakPolarHBondContact O-CA 3.31Å; L19-S23 WeakPolarHBondContact O-CB 3.24Å; L19-S23 PolarHBondContact O-N 3.49Å; L19-S23 PolarHBondContact O-OG 3.33Å
20	M	63.3	Low	59.2	Low	131 Å²	131	97.3 Å²	97.3	65%	0.645	60%	0.598	S	S	*	*	H	α-helix	trans	-65.2	-34.9	178.7	-73.5	-176.6	-159.4	0	0	113	T16 V17 S23 S24	T16-M20 WeakPolarHBondContact O-CB 3.4Å; T16-M20 VanDerWaalsContact O-CG 3.25Å; T16-M20 WeakPolarHBondContact O-CG 3.32Å; T16-M20 PolarHBondContact O-N 2.85Å; V17-M20 PolarHBondContact O-N 3.42Å; M20-S23 WeakPolarHBondContact CA-OG 3.47Å; M20-S23 CarbonylContact O-C 3.4Å; M20-S24 PolarHBondContact O-N 3.33Å
21	V	60.7	Low	60	Low	99 Å²	99	96.7 Å²	96.7	60%	0.6	59%	0.588	S	S	*	*	H	α-helix	trans	-69.9	-44.8	175.1	171.3	0	0	0	0	110.6	V17 T18 L19 S23 S24	V17-V21 HydrophobicContact CG1-CG2 4.35Å; V17-V21 WeakPolarHBondContact O-CB 3.25Å; V17-V21 VanDerWaalsContact O-CG2 3.23Å; V17-V21 WeakPolarHBondContact O-CG2 3.41Å; V17-V21 PolarHBondContact O-N 3.48Å; T18-V21 PolarHBondContact O-N 3.02Å; L19-V21 VanDerWaalsContact C-N 3.34Å; L19-V21 PolarHBondContact O-N 3.17Å; V21-S23 VanDerWaalsContact C-N 3.35Å; V21-S24 PolarHBondContact O-N 3.03Å; V21-S24 PolarHBondContact O-OG 3.08Å
22	L	57.5	Low	61.2	Low	148 Å²	148	98.1 Å²	98.1	78%	0.775	59%	0.594	S	S	*	*	H	α-helix	trans	-71.9	-27.4	176	-77.9	161.3	0	0	0	113.2	T18 L19 S24	T18-L22 HydrophobicContact CG2-CD1 3.99Å; T18-L22 VanDerWaalsContact O-CB 3.29Å; T18-L22 WeakPolarHBondContact O-CB 3.17Å; T18-L22 WeakPolarHBondContact O-CD1 3.23Å; T18-L22 WeakPolarHBondContact O-CG 3.36Å; T18-L22 PolarHBondContact O-N 2.97Å; L19-L22 CarbonylContact O-C 3.52Å; L19-L22 PolarHBondContact O-N 2.97Å; L22-S24 VanDerWaalsContact C-N 3.35Å
23	S	56.3	Low	62.8	Low	71 Å²	71	99.6 Å²	99.6	50%	0.497	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	23.8	176.5	80.8	0	0	0	0	111.4	L19 M20 V21 P25	L19-S23 WeakPolarHBondContact O-CA 3.31Å; L19-S23 WeakPolarHBondContact O-CB 3.24Å; L19-S23 PolarHBondContact O-N 3.49Å; L19-S23 PolarHBondContact O-OG 3.33Å; M20-S23 WeakPolarHBondContact CA-OG 3.47Å; M20-S23 CarbonylContact O-C 3.4Å; V21-S23 VanDerWaalsContact C-N 3.35Å; S23-P25 WeakPolarHBondContact O-CD 3.09Å
24	S	52.2	Low	64.2	Low	66 Å²	66	102 Å²	102	46%	0.462	60%	0.603	S	S	.	*			trans	-54.3	112.2	165.6	-70.8	0	0	0	0	106.2	M20 V21 L22 L26	M20-S24 PolarHBondContact O-N 3.33Å; V21-S24 PolarHBondContact O-N 3.03Å; V21-S24 PolarHBondContact O-OG 3.08Å; L22-S24 VanDerWaalsContact C-N 3.35Å; S24-L26 PolarHBondContact O-N 3.14Å
25	P	56.2	Low	65.6	Low	121 Å²	121	107.1 Å²	107.1	79%	0.786	61%	0.613	S	S	*	*			trans	-79.1	66.3	171.9	34.8	-26.7	0	0	0	105.1	S23 A27	S23-P25 WeakPolarHBondContact O-CD 3.09Å; P25-A27 PolarHBondContact O-N 3.46Å
26	L	53.9	Low	67.1	Low	150 Å²	150	109.4 Å²	109.4	79%	0.785	62%	0.62	S	S	*	*			trans	-65.9	73.1	141.6	-87.2	137.7	0	0	0	104.4	S24 L28	S24-L26 PolarHBondContact O-N 3.14Å; L26-L28 VanDerWaalsContact C-N 3.29Å; L26-L28 PolarHBondContact O-N 3.28Å
27	A	57.5	Low	68.6	Low	78 Å²	78	110.9 Å²	110.9	65%	0.645	62%	0.624	S	S	*	*			trans	-40.8	113.7	142	0	0	0	0	0	103.3	P25 A29	P25-A27 PolarHBondContact O-N 3.46Å; A27-A29 PolarHBondContact O-N 2.93Å
28	L	56.3	Low	70.2	Confident	169 Å²	169	111 Å²	111	89%	0.885	62%	0.619	S	S	*	*			trans	-52.1	97.3	164.8	-118.3	79.6	0	0	0	103.5	L26 G30	L26-L28 VanDerWaalsContact C-N 3.29Å; L26-L28 PolarHBondContact O-N 3.28Å; L28-G30 PolarHBondContact O-N 3.49Å
29	A	59.8	Low	71.9	Confident	80 Å²	80	111.9 Å²	111.9	66%	0.661	62%	0.615	S	S	*	*			trans	-64.1	94.4	163.9	0	0	0	0	0	102	A27 D31 T32	A27-A29 PolarHBondContact O-N 2.93Å; A29-D31 PolarHBondContact O-N 3.48Å; A29-T32 HydrophobicContact CB-CG2 4.42Å
30	G	66.2	Low	73.7	Confident	55 Å²	55	110 Å²	110	57%	0.567	61%	0.611	S	S	*	*			trans	-47.3	136	168.1	0	0	0	0	0	106.6	L28 T32	L28-G30 PolarHBondContact O-N 3.49Å; G30-T32 WeakPolarHBondContact O-CG2 3.45Å; G30-T32 PolarHBondContact O-N 3.11Å
31	D	71.9	Confident	75.3	Confident	69 Å²	69	105.6 Å²	105.6	37%	0.369	59%	0.592	S	S	.	*			trans	-31.5	102.8	-177	-175.3	8.7	0	0	0	112.4	A29 R33 R35	A29-D31 PolarHBondContact O-N 3.48Å; D31-R33 PolarHBondContact O-N 2.96Å; D31-R33 WeakPolarHBondContact OD1-CB 3.17Å; D31-R33 WeakPolarHBondContact OD1-CG 3.5Å; D31-R33 IonicContact OD1-CZ 2.65Å; D31-R33 PolarHBondContact OD1-N 3.43Å; D31-R33 IonicContact OD1-NE 3.8Å; D31-R33 PolarHBondContact OD1-NE 3.37Å; D31-R33 IonicContact OD1-NH2 3.73Å; D31-R33 PolarHBondContact OD1-NH2 3.49Å; D31-R33 IonicContact OD2-CZ 3.96Å; D31-R33 IonicContact OD2-NE 3.66Å; D31-R33 PolarHBondContact OD2-NE 2.88Å; D31-R33 IonicContact OD2-NH2 2.83Å; D31-R33 PolarHBondContact OD2-NH2 3.27Å; D31-R35 IonicContact OD2-NH2 3.34Å
32	T	77.8	Confident	77.1	Confident	124 Å²	124	103 Å²	103	76%	0.761	58%	0.584	S	S	*	*			trans	-82.4	4.7	-172.8	52.9	0	0	0	0	112.6	A29 G30	A29-T32 HydrophobicContact CB-CG2 4.42Å; G30-T32 WeakPolarHBondContact O-CG2 3.45Å; G30-T32 PolarHBondContact O-N 3.11Å
33	R	90.8	Very high	79.1	Confident	174 Å²	174	97.8 Å²	97.8	66%	0.657	56%	0.556	S	S	*	*	S	Bend	trans	-63.9	134.7	176	-71	178.8	-69.6	-179.8	2.1	109.3	D31 R35	D31-R33 PolarHBondContact O-N 2.96Å; D31-R33 WeakPolarHBondContact OD1-CB 3.17Å; D31-R33 WeakPolarHBondContact OD1-CG 3.5Å; D31-R33 IonicContact OD1-CZ 2.65Å; D31-R33 PolarHBondContact OD1-N 3.43Å; D31-R33 IonicContact OD1-NE 3.8Å; D31-R33 PolarHBondContact OD1-NE 3.37Å; D31-R33 IonicContact OD1-NH2 3.73Å; D31-R33 PolarHBondContact OD1-NH2 3.49Å; D31-R33 IonicContact OD2-CZ 3.96Å; D31-R33 IonicContact OD2-NE 3.66Å; D31-R33 PolarHBondContact OD2-NE 2.88Å; D31-R33 IonicContact OD2-NH2 2.83Å; D31-R33 PolarHBondContact OD2-NH2 3.27Å; R33-R35 PolarHBondContact O-N 3.43Å
34	P	90	Very high	81.1	Confident	102 Å²	102	96.1 Å²	96.1	66%	0.662	54%	0.544	S	S	*	.			trans	-58.9	134.7	174.4	26.2	-33.4	0	0	0	109.1	F36	P34-F36 HydrophobicContact CB-CE2 3.96Å; P34-F36 HydrophobicContact CB-CZ 3.81Å; P34-F36 HydrophobicContact CG-CE2 4.12Å; P34-F36 HydrophobicContact CG-CZ 4.22Å
35	R	91.3	Very high	83.3	Confident	190 Å²	190	97.6 Å²	97.6	72%	0.717	54%	0.54	S	S	*	.			trans	-109.1	137.8	176.6	-65.2	-172.4	179.4	-173.5	-2.1	108.7	D31 R33	D31-R35 IonicContact OD2-NH2 3.34Å; R33-R35 PolarHBondContact O-N 3.43Å
36	F	94.9	Very high	85.3	Confident	143 Å²	143	95.4 Å²	95.4	63%	0.627	52%	0.518	S	S	*	.			trans	-125.5	127.1	177.5	-52.7	-74.7	0	0	0	106.7	P34 Y61	P34-F36 HydrophobicContact CB-CE2 3.96Å; P34-F36 HydrophobicContact CB-CZ 3.81Å; P34-F36 HydrophobicContact CG-CE2 4.12Å; P34-F36 HydrophobicContact CG-CZ 4.22Å; F36-Y61 AromaticContact CD1-CZ 3.98Å; F36-Y61 WeakPolarHBondContact CD1-OH 3.41Å
37	L	97.3	Very high	87.4	Confident	98 Å²	98	93 Å²	93	51%	0.513	50%	0.502	S	S	.	.			trans	-122.8	122.4	177.7	178.7	65.4	0	0	0	108.2	Y39 N62	L37-Y39 HydrophobicContact CD2-CD1 4.05Å; L37-Y39 HydrophobicContact CD2-CE1 4.29Å; L37-Y39 HydrophobicContact CG-CD1 3.99Å; L37-N62 PolarHBondContact N-OD1 3.32Å; L37-N62 WeakPolarHBondContact O-CA 3.38Å; L37-N62 PolarHBondContact O-N 2.93Å
38	E	97.4	Very high	89.3	Confident	91 Å²	91	95.8 Å²	95.8	43%	0.425	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.9	168.9	179.7	64.5	-158.2	0	0	107.3	F60 Y61 Y66	E38-F60 WeakPolarHBondContact CA-O 3.48Å; E38-F60 VanDerWaalsContact CD-O 3.3Å; E38-F60 VanDerWaalsContact OE2-O 3.1Å; E38-Y61 WeakPolarHBondContact OE2-CD2 3.16Å; E38-Y66 WeakPolarHBondContact OE1-CE1 3.14Å; E38-Y66 VanDerWaalsContact OE1-CZ 3.31Å; E38-Y66 PolarHBondContact OE1-OH 3.03Å
39	Y	98.2	Very high	91.1	Very high	86 Å²	86	89.3 Å²	89.3	34%	0.337	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	160.3	173.9	68.7	-80.6	0	0	0	111.3	L37 T41 F60 N62	L37-Y39 HydrophobicContact CD2-CD1 4.05Å; L37-Y39 HydrophobicContact CD2-CE1 4.29Å; L37-Y39 HydrophobicContact CG-CD1 3.99Å; Y39-T41 HydrophobicContact CD2-CG2 4.25Å; Y39-T41 HydrophobicContact CE2-CG2 4.21Å; Y39-F60 HydrophobicContact CD1-CB 3.84Å; Y39-F60 HydrophobicContact CD2-CB 4.26Å; Y39-F60 AromaticContact CD2-CD2 3.83Å; Y39-F60 HydrophobicContact CD2-CD2 3.83Å; Y39-F60 HydrophobicContact CD2-CG 4.29Å; Y39-F60 HydrophobicContact CE1-CB 3.42Å; Y39-F60 VanDerWaalsContact CE1-CB 3.42Å; Y39-F60 HydrophobicContact CE1-CG 4.03Å; Y39-F60 HydrophobicContact CE2-CB 3.86Å; Y39-F60 HydrophobicContact CE2-CD1 4.31Å; Y39-F60 AromaticContact CE2-CD2 3.37Å; Y39-F60 HydrophobicContact CE2-CD2 3.37Å; Y39-F60 AromaticContact CE2-CE2 3.89Å; Y39-F60 HydrophobicContact CE2-CE2 3.89Å; Y39-F60 AromaticContact CE2-CG 3.61Å; Y39-F60 HydrophobicContact CE2-CG 3.61Å; Y39-F60 HydrophobicContact CG-CB 4.25Å; Y39-F60 VanDerWaalsContact CZ-CB 3.42Å; Y39-F60 AromaticContact CZ-CD1 3.95Å; Y39-F60 AromaticContact CZ-CD2 3.78Å; Y39-F60 AromaticContact CZ-CG 3.47Å; Y39-F60 VanDerWaalsContact CZ-CG 3.47Å; Y39-F60 PolarHBondContact N-O 3.47Å; Y39-F60 PolarHBondContact O-N 3.48Å; Y39-F60 WeakPolarHBondContact OH-CD1 3.4Å; Y39-N62 WeakPolarHBondContact CE1-O 3.48Å
40	S	97.9	Very high	92.9	Very high	66 Å²	66	88 Å²	88	46%	0.462	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	160.2	173.5	64.1	0	0	0	0	111.6	R58	S40-R58 CarbonylContact C-O 3.46Å; S40-R58 WeakPolarHBondContact CA-O 3.34Å; S40-R58 VanDerWaalsContact CB-O 3.25Å; S40-R58 WeakPolarHBondContact CB-O 3.47Å
41	T	98.4	Very high	94.3	Very high	38 Å²	38	92 Å²	92	23%	0.233	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	124.9	174.9	62.5	0	0	0	0	110	Y39 E43 R58 F60	Y39-T41 HydrophobicContact CD2-CG2 4.25Å; Y39-T41 HydrophobicContact CE2-CG2 4.21Å; T41-E43 PolarHBondContact OG1-OE1 2.98Å; T41-R58 PolarHBondContact N-O 2.87Å; T41-R58 PolarHBondContact O-N 3.45Å; T41-R58 WeakPolarHBondContact OG1-CB 3.45Å; T41-F60 HydrophobicContact CG2-CE2 3.94Å
42	G	98.2	Very high	95.6	Very high	43 Å²	43	95.5 Å²	95.5	44%	0.443	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	106.1	165.5	0	0	0	0	0	109.7	L56	G42-L56 CarbonylContact C-O 3.51Å; G42-L56 WeakPolarHBondContact CA-O 3.45Å
43	E	98.6	Very high	96.5	Very high	39 Å²	39	90 Å²	90	18%	0.182	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.4	-173.7	-54.6	175.8	-179	0	0	110.3	T41 Y45 F55 L56 R58	T41-E43 PolarHBondContact OG1-OE1 2.98Å; E43-Y45 HydrophobicContact CB-CD2 4.37Å; E43-Y45 HydrophobicContact CB-CE2 3.66Å; E43-Y45 VanDerWaalsContact OE2-CE2 3.25Å; E43-Y45 WeakPolarHBondContact OE2-CE2 3.02Å; E43-Y45 VanDerWaalsContact OE2-CZ 3.29Å; E43-Y45 PolarHBondContact OE2-OH 2.88Å; E43-F55 CarbonylContact O-C 3.58Å; E43-F55 WeakPolarHBondContact O-CA 3.36Å; E43-F55 WeakPolarHBondContact O-CD2 3.49Å; E43-L56 HydrophobicContact CB-CB 4.23Å; E43-L56 PolarHBondContact N-O 2.98Å; E43-L56 PolarHBondContact O-N 2.92Å; E43-R58 VanDerWaalsContact OE1-CD 3.24Å; E43-R58 WeakPolarHBondContact OE1-CD 3.34Å; E43-R58 IonicContact OE1-CZ 3.21Å; E43-R58 IonicContact OE1-NE 3.77Å; E43-R58 IonicContact OE1-NH1 3.42Å; E43-R58 PolarHBondContact OE1-NH1 3.39Å; E43-R58 IonicContact OE2-NH1 3.51Å
44	C	98.6	Very high	96.9	Very high	36 Å²	36	85.2 Å²	85.2	24%	0.243	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	115.3	173.9	-63.2	0	0	0	0	109.9	F46 C108	C44-F46 HydrophobicContact CB-CD2 4.42Å; C44-F46 HydrophobicContact CB-CE2 3.54Å; C44-F46 HydrophobicContact CB-CZ 3.6Å; C44-F46 WeakPolarHBondContact O-CD2 3.1Å; C44-F46 WeakPolarHBondContact O-CE2 3.15Å; C44-C108 HydrophobicContact CB-CB 3.64Å; C44-C108 WeakPolarHBondContact CB-SG 3.47Å; C44-C108 WeakPolarHBondContact SG-CA 3.42Å; C44-C108 WeakPolarHBondContact SG-CB 3.24Å; C44-C108 CovalentContact SG-SG 2.04Å; C44-C108 PolarHBondContact SG-SG 3.41Å
45	Y	98.5	Very high	97.3	Very high	98 Å²	98	80.6 Å²	80.6	38%	0.384	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.6	175.8	-63.8	-93	0	0	0	109.9	E43 V53 R54 L56	E43-Y45 HydrophobicContact CB-CD2 4.37Å; E43-Y45 HydrophobicContact CB-CE2 3.66Å; E43-Y45 VanDerWaalsContact OE2-CE2 3.25Å; E43-Y45 WeakPolarHBondContact OE2-CE2 3.02Å; E43-Y45 VanDerWaalsContact OE2-CZ 3.29Å; E43-Y45 PolarHBondContact OE2-OH 2.88Å; Y45-V53 VanDerWaalsContact O-CA 3.31Å; Y45-V53 WeakPolarHBondContact O-CA 3.43Å; Y45-R54 PolarHBondContact N-O 2.67Å; Y45-R54 PolarHBondContact O-N 2.8Å; Y45-L56 HydrophobicContact CD2-CG 4.49Å; Y45-L56 HydrophobicContact CE2-CD1 3.75Å; Y45-L56 HydrophobicContact CE2-CG 4.07Å
46	F	98.4	Very high	97.7	Very high	74 Å²	74	72 Å²	72	33%	0.325	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.8	-176	-63	-78.9	0	0	0	110.4	C44 G49 T50 V53 C108 Y112	C44-F46 HydrophobicContact CB-CD2 4.42Å; C44-F46 HydrophobicContact CB-CE2 3.54Å; C44-F46 HydrophobicContact CB-CZ 3.6Å; C44-F46 WeakPolarHBondContact O-CD2 3.1Å; C44-F46 WeakPolarHBondContact O-CE2 3.15Å; F46-G49 WeakPolarHBondContact CB-O 3.29Å; F46-T50 HydrophobicContact CD1-CG2 4.16Å; F46-T50 HydrophobicContact CE1-CG2 4.34Å; F46-V53 HydrophobicContact CD1-CG1 4.23Å; F46-V53 HydrophobicContact CD1-CG2 3.8Å; F46-V53 HydrophobicContact CE1-CG1 4.03Å; F46-V53 HydrophobicContact CE1-CG2 4.08Å; F46-C108 HydrophobicContact CE1-CB 4.18Å; F46-C108 HydrophobicContact CZ-CB 4.05Å; F46-C108 WeakPolarHBondContact CZ-O 3.36Å; F46-Y112 HydrophobicContact CB-CE2 4.45Å; F46-Y112 AromaticContact CD1-CD2 3.57Å; F46-Y112 HydrophobicContact CD1-CD2 3.57Å; F46-Y112 HydrophobicContact CD1-CE2 4.23Å; F46-Y112 HydrophobicContact CD1-CG 4.24Å; F46-Y112 HydrophobicContact CD2-CD2 4.08Å; F46-Y112 AromaticContact CE1-CD2 3.69Å; F46-Y112 HydrophobicContact CE1-CD2 3.69Å; F46-Y112 HydrophobicContact CE1-CG 4.01Å; F46-Y112 HydrophobicContact CE2-CD2 4.16Å; F46-Y112 AromaticContact CG-CD2 3.79Å; F46-Y112 HydrophobicContact CG-CD2 3.79Å; F46-Y112 HydrophobicContact CG-CE2 4.2Å; F46-Y112 AromaticContact CZ-CD2 3.98Å; F46-Y112 HydrophobicContact CZ-CD2 3.98Å; F46-Y112 HydrophobicContact CZ-CG 4.37Å
47	F	97.8	Very high	97.9	Very high	100 Å²	100	66 Å²	66	44%	0.439	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127	178.3	-54.3	-88.4	0	0	0	109.5	R52 R54	F47-R52 HydrophobicContact CB-CB 4.21Å; F47-R52 HydrophobicContact CD2-CB 4.47Å; F47-R52 HydrophobicContact CD2-CG 4.12Å; F47-R52 PolarHBondContact N-O 3.45Å; F47-R52 PolarHBondContact O-N 3.36Å; F47-R54 HydrophobicContact CE2-CB 4.48Å
48	N	96.4	Very high	97.9	Very high	137 Å²	137	63.9 Å²	63.9	73%	0.733	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	57	-174.7	-162.1	30	0	0	0	112.3	T50 E51	N48-T50 PolarHBondContact O-N 3.07Å; N48-E51 PolarHBondContact ND2-OE2 3.39Å
49	G	94.7	Very high	98	Very high	32 Å²	32	61.7 Å²	61.7	33%	0.33	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	-125.3	-169.5	0	0	0	0	0	110.9	F46	F46-G49 WeakPolarHBondContact CB-O 3.29Å
50	T	97.4	Very high	98	Very high	52 Å²	52	58.4 Å²	58.4	32%	0.319	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	13.2	-178.8	55.5	0	0	0	0	113.6	F46 N48 R109 Y112	F46-T50 HydrophobicContact CD1-CG2 4.16Å; F46-T50 HydrophobicContact CE1-CG2 4.34Å; N48-T50 PolarHBondContact O-N 3.07Å; T50-R109 HydrophobicContact CG2-CG 4.43Å; T50-R109 PolarHBondContact O-NE 3.05Å; T50-Y112 HydrophobicContact CG2-CD1 3.36Å; T50-Y112 HydrophobicContact CG2-CD2 3.9Å; T50-Y112 HydrophobicContact CG2-CE1 3.75Å; T50-Y112 HydrophobicContact CG2-CE2 4.22Å; T50-Y112 HydrophobicContact CG2-CG 3.46Å; T50-Y112 VanDerWaalsContact CG2-CG 3.46Å
51	E	96.4	Very high	98	Very high	141 Å²	141	59.5 Å²	59.5	66%	0.659	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-57.6	179.5	-174.7	-177.9	176.8	0	0	110.6	N48	N48-E51 PolarHBondContact ND2-OE2 3.39Å
52	R	97.8	Very high	97.9	Very high	141 Å²	141	60.7 Å²	60.7	53%	0.532	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.7	169.5	178.4	179.8	-179	139.8	2.4	109.5	F47 D72	F47-R52 HydrophobicContact CB-CB 4.21Å; F47-R52 HydrophobicContact CD2-CB 4.47Å; F47-R52 HydrophobicContact CD2-CG 4.12Å; F47-R52 PolarHBondContact N-O 3.45Å; F47-R52 PolarHBondContact O-N 3.36Å; R52-D72 IonicContact CZ-OD2 3.69Å; R52-D72 IonicContact NH2-OD1 3.5Å; R52-D72 IonicContact NH2-OD2 2.67Å; R52-D72 PolarHBondContact NH2-OD2 3.34Å
53	V	98.6	Very high	97.8	Very high	9 Å²	9	67.3 Å²	67.3	6%	0.055	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.9	177.3	-178.1	0	0	0	0	108.5	Y45 F46 V104 C108 R109	Y45-V53 VanDerWaalsContact O-CA 3.31Å; Y45-V53 WeakPolarHBondContact O-CA 3.43Å; F46-V53 HydrophobicContact CD1-CG1 4.23Å; F46-V53 HydrophobicContact CD1-CG2 3.8Å; F46-V53 HydrophobicContact CE1-CG1 4.03Å; F46-V53 HydrophobicContact CE1-CG2 4.08Å; V53-V104 HydrophobicContact CB-CG1 3.62Å; V53-V104 HydrophobicContact CG1-CG1 3.78Å; V53-C108 HydrophobicContact CG1-CB 3.55Å; V53-R109 HydrophobicContact CG2-CG 3.95Å
54	R	98.6	Very high	97.8	Very high	73 Å²	73	70.4 Å²	70.4	28%	0.275	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.9	172.8	-179.4	-177.7	179.3	-160	4.7	109.1	Y45 F47 L56 D70 S71 D72	Y45-R54 PolarHBondContact N-O 2.67Å; Y45-R54 PolarHBondContact O-N 2.8Å; F47-R54 HydrophobicContact CE2-CB 4.48Å; R54-L56 HydrophobicContact CG-CD2 4.34Å; R54-D70 IonicContact CZ-OD1 2.65Å; R54-D70 IonicContact CZ-OD2 3.56Å; R54-D70 IonicContact NE-OD1 3.82Å; R54-D70 PolarHBondContact NE-OD1 3.22Å; R54-D70 IonicContact NE-OD2 3.44Å; R54-D70 PolarHBondContact NE-OD2 2.99Å; R54-D70 IonicContact NH2-OD1 3.45Å; R54-D70 IonicContact NH2-OD2 2.73Å; R54-D70 PolarHBondContact NH2-OD2 3.35Å; R54-S71 WeakPolarHBondContact CA-OG 3.35Å; R54-D72 IonicContact NE-OD2 2.68Å
55	F	98.8	Very high	97.8	Very high	6 Å²	6	69.8 Å²	69.8	3%	0.026	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.8	176.3	175.8	-108.6	0	0	0	110.1	E43 D57 F69 S71 L103 V104 Y107 C108	E43-F55 CarbonylContact O-C 3.58Å; E43-F55 WeakPolarHBondContact O-CA 3.36Å; E43-F55 WeakPolarHBondContact O-CD2 3.49Å; F55-D57 HydrophobicContact CE1-CB 3.74Å; F55-D57 HydrophobicContact CZ-CB 3.84Å; F55-F69 HydrophobicContact CD1-CD1 4.03Å; F55-F69 HydrophobicContact CD1-CE1 4.17Å; F55-F69 HydrophobicContact CE1-CD1 4.28Å; F55-S71 PolarHBondContact N-OG 3.47Å; F55-S71 PolarHBondContact O-N 3.03Å; F55-S71 PolarHBondContact O-OG 2.92Å; F55-L103 HydrophobicContact CD1-CB 3.82Å; F55-L103 HydrophobicContact CD1-CD1 4.12Å; F55-L103 HydrophobicContact CE1-CB 3.88Å; F55-L103 HydrophobicContact CE1-CD1 3.33Å; F55-L103 HydrophobicContact CE1-CG 4.24Å; F55-L103 HydrophobicContact CG-CB 4.19Å; F55-L103 HydrophobicContact CZ-CB 4.29Å; F55-L103 HydrophobicContact CZ-CD1 3.58Å; F55-V104 HydrophobicContact CB-CG2 4Å; F55-Y107 HydrophobicContact CE2-CD1 4.17Å; F55-Y107 HydrophobicContact CE2-CE1 4.4Å; F55-C108 VanDerWaalsContact CD2-SG 3.55Å
56	L	98.8	Very high	97.8	Very high	8 Å²	8	66.1 Å²	66.1	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.6	169.9	-55.6	-176.4	0	0	0	109.6	G42 E43 Y45 R54 R58 F69 D70	G42-L56 CarbonylContact C-O 3.51Å; G42-L56 WeakPolarHBondContact CA-O 3.45Å; E43-L56 HydrophobicContact CB-CB 4.23Å; E43-L56 PolarHBondContact N-O 2.98Å; E43-L56 PolarHBondContact O-N 2.92Å; Y45-L56 HydrophobicContact CD2-CG 4.49Å; Y45-L56 HydrophobicContact CE2-CD1 3.75Å; Y45-L56 HydrophobicContact CE2-CG 4.07Å; R54-L56 HydrophobicContact CG-CD2 4.34Å; L56-R58 HydrophobicContact CB-CG 3.98Å; L56-F69 WeakPolarHBondContact CA-O 3.03Å; L56-D70 HydrophobicContact CD2-CB 3.65Å; L56-D70 WeakPolarHBondContact CD2-OD1 3.11Å
57	D	98.6	Very high	97.8	Very high	17 Å²	17	62.6 Å²	62.6	9%	0.091	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	111.5	166.3	-168.1	22.4	0	0	0	107.9	F55 Y59 R68 F69 Y76	F55-D57 HydrophobicContact CE1-CB 3.74Å; F55-D57 HydrophobicContact CZ-CB 3.84Å; D57-Y59 HydrophobicContact CB-CE2 4.45Å; D57-Y59 VanDerWaalsContact OD2-CE2 3.28Å; D57-Y59 WeakPolarHBondContact OD2-CE2 3.41Å; D57-Y59 PolarHBondContact OD2-OH 3.01Å; D57-R68 CarbonylContact O-C 3.59Å; D57-R68 VanDerWaalsContact O-CA 3.25Å; D57-R68 WeakPolarHBondContact O-CA 3.22Å; D57-F69 HydrophobicContact CB-CB 4.13Å; D57-F69 PolarHBondContact N-O 3.46Å; D57-F69 PolarHBondContact O-N 3.48Å; D57-Y76 PolarHBondContact OD2-OH 3.45Å
58	R	98.7	Very high	97.9	Very high	54 Å²	54	61.4 Å²	61.4	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.5	-168.7	-48.6	172	69.6	-167.1	-0.7	109.6	S40 T41 E43 L56 F60 E65 R68	S40-R58 CarbonylContact C-O 3.46Å; S40-R58 WeakPolarHBondContact CA-O 3.34Å; S40-R58 VanDerWaalsContact CB-O 3.25Å; S40-R58 WeakPolarHBondContact CB-O 3.47Å; T41-R58 PolarHBondContact N-O 2.87Å; T41-R58 PolarHBondContact O-N 3.45Å; T41-R58 WeakPolarHBondContact OG1-CB 3.45Å; E43-R58 VanDerWaalsContact OE1-CD 3.24Å; E43-R58 WeakPolarHBondContact OE1-CD 3.34Å; E43-R58 IonicContact OE1-CZ 3.21Å; E43-R58 IonicContact OE1-NE 3.77Å; E43-R58 IonicContact OE1-NH1 3.42Å; E43-R58 PolarHBondContact OE1-NH1 3.39Å; E43-R58 IonicContact OE2-NH1 3.51Å; L56-R58 HydrophobicContact CB-CG 3.98Å; R58-F60 HydrophobicContact CB-CD2 4.42Å; R58-F60 HydrophobicContact CB-CE2 3.54Å; R58-F60 HydrophobicContact CB-CZ 3.89Å; R58-E65 HydrophobicContact CB-CG 4.44Å; R58-E65 IonicContact CZ-OE1 2.68Å; R58-E65 IonicContact CZ-OE2 3.44Å; R58-E65 VanDerWaalsContact NE-CD 3.28Å; R58-E65 IonicContact NE-OE1 2.97Å; R58-E65 PolarHBondContact NE-OE1 3.5Å; R58-E65 IonicContact NE-OE2 3.78Å; R58-E65 PolarHBondContact NE-OE2 3.04Å; R58-E65 IonicContact NH2-OE1 2.75Å; R58-E65 IonicContact NH2-OE2 3.43Å; R58-E65 PolarHBondContact NH2-OE2 3.28Å; R58-R68 HydrophobicContact CG-CB 4.48Å; R58-R68 HydrophobicContact CG-CG 3.94Å
59	Y	98.6	Very high	98	Very high	46 Å²	46	54.9 Å²	54.9	18%	0.18	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.7	-179.7	-63.4	-105.3	0	0	0	110.1	D57 E65 Y66 V67 Y76 W90	D57-Y59 HydrophobicContact CB-CE2 4.45Å; D57-Y59 VanDerWaalsContact OD2-CE2 3.28Å; D57-Y59 WeakPolarHBondContact OD2-CE2 3.41Å; D57-Y59 PolarHBondContact OD2-OH 3.01Å; Y59-E65 WeakPolarHBondContact O-CA 3.34Å; Y59-Y66 VanDerWaalsContact CB-CZ 3.5Å; Y59-Y66 WeakPolarHBondContact O-CD1 3.26Å; Y59-Y66 PolarHBondContact O-N 2.99Å; Y59-V67 HydrophobicContact CD2-CG1 3.94Å; Y59-V67 HydrophobicContact CG-CG1 4.06Å; Y59-V67 PolarHBondContact N-O 3.23Å; Y59-Y76 HydrophobicContact CE2-CE1 4.04Å; Y59-W90 HydrophobicContact CD1-CH2 4.11Å; Y59-W90 HydrophobicContact CD2-CH2 4.05Å; Y59-W90 AromaticContact CD2-CZ3 3.97Å; Y59-W90 HydrophobicContact CD2-CZ3 3.97Å; Y59-W90 AromaticContact CE1-CH2 3.98Å; Y59-W90 HydrophobicContact CE1-CH2 3.98Å; Y59-W90 AromaticContact CE2-CH2 3.95Å; Y59-W90 HydrophobicContact CE2-CH2 3.95Å; Y59-W90 AromaticContact CE2-CZ3 3.85Å; Y59-W90 HydrophobicContact CE2-CZ3 3.85Å; Y59-W90 HydrophobicContact CG-CH2 4.17Å; Y59-W90 HydrophobicContact CG-CZ3 4.5Å; Y59-W90 AromaticContact CZ-CH2 3.93Å
60	F	98.7	Very high	98.2	Very high	16 Å²	16	54 Å²	54	7%	0.07	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.9	-170.5	-59.1	-99.3	0	0	0	111.5	E38 Y39 T41 R58 E64 E65	E38-F60 WeakPolarHBondContact CA-O 3.48Å; E38-F60 VanDerWaalsContact CD-O 3.3Å; E38-F60 VanDerWaalsContact OE2-O 3.1Å; Y39-F60 HydrophobicContact CD1-CB 3.84Å; Y39-F60 HydrophobicContact CD2-CB 4.26Å; Y39-F60 AromaticContact CD2-CD2 3.83Å; Y39-F60 HydrophobicContact CD2-CD2 3.83Å; Y39-F60 HydrophobicContact CD2-CG 4.29Å; Y39-F60 HydrophobicContact CE1-CB 3.42Å; Y39-F60 VanDerWaalsContact CE1-CB 3.42Å; Y39-F60 HydrophobicContact CE1-CG 4.03Å; Y39-F60 HydrophobicContact CE2-CB 3.86Å; Y39-F60 HydrophobicContact CE2-CD1 4.31Å; Y39-F60 AromaticContact CE2-CD2 3.37Å; Y39-F60 HydrophobicContact CE2-CD2 3.37Å; Y39-F60 AromaticContact CE2-CE2 3.89Å; Y39-F60 HydrophobicContact CE2-CE2 3.89Å; Y39-F60 AromaticContact CE2-CG 3.61Å; Y39-F60 HydrophobicContact CE2-CG 3.61Å; Y39-F60 HydrophobicContact CG-CB 4.25Å; Y39-F60 VanDerWaalsContact CZ-CB 3.42Å; Y39-F60 AromaticContact CZ-CD1 3.95Å; Y39-F60 AromaticContact CZ-CD2 3.78Å; Y39-F60 AromaticContact CZ-CG 3.47Å; Y39-F60 VanDerWaalsContact CZ-CG 3.47Å; Y39-F60 PolarHBondContact N-O 3.47Å; Y39-F60 PolarHBondContact O-N 3.48Å; Y39-F60 WeakPolarHBondContact OH-CD1 3.4Å; T41-F60 HydrophobicContact CG2-CE2 3.94Å; R58-F60 HydrophobicContact CB-CD2 4.42Å; R58-F60 HydrophobicContact CB-CE2 3.54Å; R58-F60 HydrophobicContact CB-CZ 3.89Å; F60-E64 VanDerWaalsContact CA-O 3.3Å; F60-E64 WeakPolarHBondContact CA-O 3.11Å; F60-E65 HydrophobicContact CD1-CB 3.72Å; F60-E65 HydrophobicContact CD1-CG 4.39Å; F60-E65 HydrophobicContact CE1-CB 3.55Å; F60-E65 HydrophobicContact CE1-CG 4.03Å; F60-E65 HydrophobicContact CZ-CB 4.29Å; F60-E65 HydrophobicContact CZ-CG 4.27Å
61	Y	98.1	Very high	98.2	Very high	89 Å²	89	52.8 Å²	52.8	35%	0.349	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.8	164.6	-169.4	-103	0	0	0	108.5	F36 E38 Q63 E64 L82	F36-Y61 AromaticContact CD1-CZ 3.98Å; F36-Y61 WeakPolarHBondContact CD1-OH 3.41Å; E38-Y61 WeakPolarHBondContact OE2-CD2 3.16Å; Y61-Q63 PolarHBondContact O-N 3.48Å; Y61-E64 PolarHBondContact N-O 3.17Å; Y61-E64 PolarHBondContact O-N 2.92Å; Y61-L82 HydrophobicContact CG-CD2 4.36Å
62	N	95.9	Very high	98.3	Very high	63 Å²	63	50 Å²	50	34%	0.337	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	-80.5	-169.8	-59.5	-49.4	0	0	0	114.4	L37 Y39	L37-N62 PolarHBondContact N-OD1 3.32Å; L37-N62 WeakPolarHBondContact O-CA 3.38Å; L37-N62 PolarHBondContact O-N 2.93Å; Y39-N62 WeakPolarHBondContact CE1-O 3.48Å
63	Q	96.5	Very high	98.4	Very high	182 Å²	182	47 Å²	47	85%	0.85	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-138.8	2.7	175.4	-66.2	-178.7	-1.3	0	0	111.2	Y61	Y61-Q63 PolarHBondContact O-N 3.48Å
64	E	98.2	Very high	98.3	Very high	105 Å²	105	47 Å²	47	49%	0.491	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	113	-178.4	-171.4	-179.5	153	0	0	108.9	F60 Y61 Y66 T80	F60-E64 VanDerWaalsContact CA-O 3.3Å; F60-E64 WeakPolarHBondContact CA-O 3.11Å; Y61-E64 PolarHBondContact N-O 3.17Å; Y61-E64 PolarHBondContact O-N 2.92Å; E64-Y66 PolarHBondContact O-N 3.28Å; E64-T80 HydrophobicContact CG-CG2 3.92Å; E64-T80 WeakPolarHBondContact OE1-CB 3.35Å; E64-T80 WeakPolarHBondContact OE1-CG2 3.43Å; E64-T80 PolarHBondContact OE1-OG1 3.31Å
65	E	98.6	Very high	98.3	Very high	23 Å²	23	46.2 Å²	46.2	11%	0.107	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	117.8	169	-173.2	-176.8	-171.1	0	0	108.3	R58 Y59 F60 R68 V79	R58-E65 HydrophobicContact CB-CG 4.44Å; R58-E65 IonicContact CZ-OE1 2.68Å; R58-E65 IonicContact CZ-OE2 3.44Å; R58-E65 VanDerWaalsContact NE-CD 3.28Å; R58-E65 IonicContact NE-OE1 2.97Å; R58-E65 PolarHBondContact NE-OE1 3.5Å; R58-E65 IonicContact NE-OE2 3.78Å; R58-E65 PolarHBondContact NE-OE2 3.04Å; R58-E65 IonicContact NH2-OE1 2.75Å; R58-E65 IonicContact NH2-OE2 3.43Å; R58-E65 PolarHBondContact NH2-OE2 3.28Å; Y59-E65 WeakPolarHBondContact O-CA 3.34Å; F60-E65 HydrophobicContact CD1-CB 3.72Å; F60-E65 HydrophobicContact CD1-CG 4.39Å; F60-E65 HydrophobicContact CE1-CB 3.55Å; F60-E65 HydrophobicContact CE1-CG 4.03Å; F60-E65 HydrophobicContact CZ-CB 4.29Å; F60-E65 HydrophobicContact CZ-CG 4.27Å; E65-R68 WeakPolarHBondContact OE1-CB 3.31Å; E65-R68 VanDerWaalsContact OE1-CD 3.27Å; E65-R68 WeakPolarHBondContact OE1-CD 3.36Å; E65-R68 IonicContact OE1-CZ 2.78Å; E65-R68 IonicContact OE1-NE 3.4Å; E65-R68 IonicContact OE1-NH1 3.5Å; E65-R68 PolarHBondContact OE1-NH1 3.44Å; E65-R68 IonicContact OE2-NH1 3.82Å; E65-R68 PolarHBondContact OE2-NH1 3.24Å; E65-V79 HydrophobicContact CB-CG1 4.3Å; E65-V79 HydrophobicContact CG-CB 4.32Å; E65-V79 HydrophobicContact CG-CG1 4.35Å; E65-V79 HydrophobicContact CG-CG2 4.04Å; E65-V79 WeakPolarHBondContact O-CB 3.33Å; E65-V79 VanDerWaalsContact O-CG1 3.25Å; E65-V79 WeakPolarHBondContact O-CG1 3.46Å
66	Y	98.6	Very high	98.3	Very high	21 Å²	21	46 Å²	46	8%	0.082	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-28	-175.8	64.2	-92.5	0	0	0	113.2	E38 Y59 E64 V79 T80 L82 G83 D86	E38-Y66 WeakPolarHBondContact OE1-CE1 3.14Å; E38-Y66 VanDerWaalsContact OE1-CZ 3.31Å; E38-Y66 PolarHBondContact OE1-OH 3.03Å; Y59-Y66 VanDerWaalsContact CB-CZ 3.5Å; Y59-Y66 WeakPolarHBondContact O-CD1 3.26Å; Y59-Y66 PolarHBondContact O-N 2.99Å; E64-Y66 PolarHBondContact O-N 3.28Å; Y66-V79 PolarHBondContact O-N 3.39Å; Y66-T80 PolarHBondContact O-N 3.05Å; Y66-L82 HydrophobicContact CD1-CD2 4.26Å; Y66-L82 HydrophobicContact CD2-CG 4.45Å; Y66-L82 HydrophobicContact CG-CD2 4.1Å; Y66-L82 HydrophobicContact CG-CG 4.28Å; Y66-G83 WeakPolarHBondContact O-CA 3.01Å; Y66-D86 WeakPolarHBondContact CE2-OD2 3.37Å
67	V	98.8	Very high	98.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	145.6	176.1	68.1	0	0	0	0	111	Y59 Y76 D86 A87 W90	Y59-V67 HydrophobicContact CD2-CG1 3.94Å; Y59-V67 HydrophobicContact CG-CG1 4.06Å; Y59-V67 PolarHBondContact N-O 3.23Å; V67-Y76 HydrophobicContact CG2-CD1 4.07Å; V67-D86 HydrophobicContact CG1-CB 4.41Å; V67-A87 HydrophobicContact CG2-CB 3.98Å; V67-W90 HydrophobicContact CG1-CH2 4.01Å; V67-W90 HydrophobicContact CG1-CZ3 3.59Å; V67-W90 HydrophobicContact CG2-CE3 4.47Å; V67-W90 HydrophobicContact CG2-CZ3 4.22Å
68	R	98.8	Very high	98.3	Very high	75 Å²	75	54 Å²	54	28%	0.283	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	137	179.2	174.3	174.6	66.3	-135.9	5.1	112.7	D57 R58 E65 Y76 R77 V79	D57-R68 CarbonylContact O-C 3.59Å; D57-R68 VanDerWaalsContact O-CA 3.25Å; D57-R68 WeakPolarHBondContact O-CA 3.22Å; R58-R68 HydrophobicContact CG-CB 4.48Å; R58-R68 HydrophobicContact CG-CG 3.94Å; E65-R68 WeakPolarHBondContact OE1-CB 3.31Å; E65-R68 VanDerWaalsContact OE1-CD 3.27Å; E65-R68 WeakPolarHBondContact OE1-CD 3.36Å; E65-R68 IonicContact OE1-CZ 2.78Å; E65-R68 IonicContact OE1-NE 3.4Å; E65-R68 IonicContact OE1-NH1 3.5Å; E65-R68 PolarHBondContact OE1-NH1 3.44Å; E65-R68 IonicContact OE2-NH1 3.82Å; E65-R68 PolarHBondContact OE2-NH1 3.24Å; R68-Y76 CarbonylContact O-C 3.51Å; R68-Y76 VanDerWaalsContact O-CA 3.3Å; R68-Y76 WeakPolarHBondContact O-CA 3.17Å; R68-R77 PolarHBondContact N-O 3.29Å; R68-R77 PolarHBondContact O-N 3Å; R68-V79 HydrophobicContact CB-CG2 4.09Å
69	F	98.8	Very high	98.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	135.2	156.6	178.4	-90.6	0	0	0	109.9	F55 L56 D57 G74 Y76 L97 R100 R101	F55-F69 HydrophobicContact CD1-CD1 4.03Å; F55-F69 HydrophobicContact CD1-CE1 4.17Å; F55-F69 HydrophobicContact CE1-CD1 4.28Å; L56-F69 WeakPolarHBondContact CA-O 3.03Å; D57-F69 HydrophobicContact CB-CB 4.13Å; D57-F69 PolarHBondContact N-O 3.46Å; D57-F69 PolarHBondContact O-N 3.48Å; F69-G74 VanDerWaalsContact CE2-C 3.42Å; F69-Y76 HydrophobicContact CB-CD1 3.64Å; F69-Y76 HydrophobicContact CB-CD2 4.11Å; F69-Y76 HydrophobicContact CB-CE1 3.49Å; F69-Y76 VanDerWaalsContact CB-CE1 3.49Å; F69-Y76 HydrophobicContact CB-CE2 3.94Å; F69-Y76 HydrophobicContact CB-CG 3.98Å; F69-Y76 HydrophobicContact CD2-CD2 4.01Å; F69-Y76 HydrophobicContact CD2-CE2 4.01Å; F69-Y76 HydrophobicContact CG-CE2 4.32Å; F69-L97 HydrophobicContact CD2-CD1 4.27Å; F69-L97 HydrophobicContact CE2-CD1 4.1Å; F69-R100 HydrophobicContact CB-CG 4.4Å; F69-R100 HydrophobicContact CD1-CB 4.24Å; F69-R100 HydrophobicContact CD1-CG 4.11Å; F69-R100 HydrophobicContact CD2-CB 3.9Å; F69-R100 HydrophobicContact CD2-CG 3.99Å; F69-R100 HydrophobicContact CE1-CB 4.04Å; F69-R100 HydrophobicContact CE1-CG 4.4Å; F69-R100 HydrophobicContact CE2-CB 3.68Å; F69-R100 HydrophobicContact CE2-CG 4.29Å; F69-R100 HydrophobicContact CG-CB 4.19Å; F69-R100 HydrophobicContact CG-CG 3.91Å; F69-R100 HydrophobicContact CZ-CB 3.77Å; F69-R100 HydrophobicContact CZ-CG 4.5Å; F69-R101 HydrophobicContact CE2-CG 4.27Å; F69-R101 HydrophobicContact CZ-CG 3.9Å
70	D	98.8	Very high	98.3	Very high	12 Å²	12	54.1 Å²	54.1	6%	0.064	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	122.8	174.7	-176.2	-13	0	0	0	108.7	R54 L56 D72 V73 G74	R54-D70 IonicContact CZ-OD1 2.65Å; R54-D70 IonicContact CZ-OD2 3.56Å; R54-D70 IonicContact NE-OD1 3.82Å; R54-D70 PolarHBondContact NE-OD1 3.22Å; R54-D70 IonicContact NE-OD2 3.44Å; R54-D70 PolarHBondContact NE-OD2 2.99Å; R54-D70 IonicContact NH2-OD1 3.45Å; R54-D70 IonicContact NH2-OD2 2.73Å; R54-D70 PolarHBondContact NH2-OD2 3.35Å; L56-D70 HydrophobicContact CD2-CB 3.65Å; L56-D70 WeakPolarHBondContact CD2-OD1 3.11Å; D70-D72 PolarHBondContact O-N 2.89Å; D70-D72 PolarHBondContact OD1-N 2.94Å; D70-V73 HydrophobicContact CB-CB 4.16Å; D70-V73 HydrophobicContact CB-CG2 3.92Å; D70-V73 CarbonylContact O-C 3.55Å; D70-V73 WeakPolarHBondContact O-CA 3.4Å; D70-V73 PolarHBondContact O-N 2.91Å; D70-G74 PolarHBondContact O-N 3.07Å
71	S	98.5	Very high	98.3	Very high	27 Å²	27	59.6 Å²	59.6	19%	0.189	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.5	-179.1	64.1	0	0	0	0	113.4	R54 F55 V73 V104	R54-S71 WeakPolarHBondContact CA-OG 3.35Å; F55-S71 PolarHBondContact N-OG 3.47Å; F55-S71 PolarHBondContact O-N 3.03Å; F55-S71 PolarHBondContact O-OG 2.92Å; S71-V73 PolarHBondContact O-N 2.89Å; S71-V104 VanDerWaalsContact CB-CG2 3.47Å
72	D	98.2	Very high	98.3	Very high	82 Å²	82	59.9 Å²	59.9	44%	0.439	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-19.1	176.9	-74.2	4	0	0	0	111.6	R52 R54 D70	R52-D72 IonicContact CZ-OD2 3.69Å; R52-D72 IonicContact NH2-OD1 3.5Å; R52-D72 IonicContact NH2-OD2 2.67Å; R52-D72 PolarHBondContact NH2-OD2 3.34Å; R54-D72 IonicContact NE-OD2 2.68Å; D70-D72 PolarHBondContact O-N 2.89Å; D70-D72 PolarHBondContact OD1-N 2.94Å
73	V	98.4	Very high	98.4	Very high	79 Å²	79	56.9 Å²	56.9	48%	0.479	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-36.4	175.4	-176.3	0	0	0	0	111.3	D70 S71 E75 R77	D70-V73 HydrophobicContact CB-CB 4.16Å; D70-V73 HydrophobicContact CB-CG2 3.92Å; D70-V73 CarbonylContact O-C 3.55Å; D70-V73 WeakPolarHBondContact O-CA 3.4Å; D70-V73 PolarHBondContact O-N 2.91Å; S71-V73 PolarHBondContact O-N 2.89Å; V73-E75 HydrophobicContact CG1-CG 4.06Å; V73-R77 HydrophobicContact CG1-CG 4.5Å
74	G	98.1	Very high	98.5	Very high	10 Å²	10	54 Å²	54	10%	0.103	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	83	11.5	177.1	0	0	0	0	0	115.1	F69 D70 R101	F69-G74 VanDerWaalsContact CE2-C 3.42Å; D70-G74 PolarHBondContact O-N 3.07Å; G74-R101 VanDerWaalsContact O-CZ 3.29Å; G74-R101 PolarHBondContact O-NE 3.27Å; G74-R101 PolarHBondContact O-NH2 3.06Å
75	E	98.6	Very high	98.5	Very high	56 Å²	56	52.7 Å²	52.7	26%	0.262	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	169.2	176.8	64.4	-178.3	-166.5	0	0	112.7	V73 R77 L97	V73-E75 HydrophobicContact CG1-CG 4.06Å; E75-R77 IonicContact OE1-CZ 2.62Å; E75-R77 IonicContact OE1-NE 2.71Å; E75-R77 PolarHBondContact OE1-NE 2.97Å; E75-R77 IonicContact OE1-NH2 3.44Å; E75-R77 PolarHBondContact OE1-NH2 3.29Å; E75-L97 HydrophobicContact CB-CD1 4.15Å; E75-L97 HydrophobicContact CB-CD2 4.23Å
76	Y	98.7	Very high	98.5	Very high	1 Å²	1	53.9 Å²	53.9	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	138.5	173.4	-73.2	-92.3	0	0	0	111.2	D57 Y59 V67 R68 F69 W90 N91 F96 L97 R100	D57-Y76 PolarHBondContact OD2-OH 3.45Å; Y59-Y76 HydrophobicContact CE2-CE1 4.04Å; V67-Y76 HydrophobicContact CG2-CD1 4.07Å; R68-Y76 CarbonylContact O-C 3.51Å; R68-Y76 VanDerWaalsContact O-CA 3.3Å; R68-Y76 WeakPolarHBondContact O-CA 3.17Å; F69-Y76 HydrophobicContact CB-CD1 3.64Å; F69-Y76 HydrophobicContact CB-CD2 4.11Å; F69-Y76 HydrophobicContact CB-CE1 3.49Å; F69-Y76 VanDerWaalsContact CB-CE1 3.49Å; F69-Y76 HydrophobicContact CB-CE2 3.94Å; F69-Y76 HydrophobicContact CB-CG 3.98Å; F69-Y76 HydrophobicContact CD2-CD2 4.01Å; F69-Y76 HydrophobicContact CD2-CE2 4.01Å; F69-Y76 HydrophobicContact CG-CE2 4.32Å; Y76-W90 AromaticContact CD1-CE3 3.41Å; Y76-W90 HydrophobicContact CD1-CE3 3.41Å; Y76-W90 VanDerWaalsContact CD1-CE3 3.41Å; Y76-W90 AromaticContact CD1-CZ3 3.71Å; Y76-W90 HydrophobicContact CD1-CZ3 3.71Å; Y76-W90 HydrophobicContact CD2-CB 3.96Å; Y76-W90 HydrophobicContact CD2-CE3 4.11Å; Y76-W90 AromaticContact CE1-CE3 3.39Å; Y76-W90 HydrophobicContact CE1-CE3 3.39Å; Y76-W90 AromaticContact CE1-CZ3 3.51Å; Y76-W90 HydrophobicContact CE1-CZ3 3.51Å; Y76-W90 HydrophobicContact CE2-CB 4.24Å; Y76-W90 HydrophobicContact CE2-CE3 4.12Å; Y76-W90 HydrophobicContact CG-CB 4.42Å; Y76-W90 AromaticContact CG-CE3 3.76Å; Y76-W90 HydrophobicContact CG-CE3 3.76Å; Y76-W90 HydrophobicContact CG-CZ3 4.49Å; Y76-W90 AromaticContact CZ-CE3 3.74Å; Y76-N91 WeakPolarHBondContact CB-OD1 3.28Å; Y76-N91 PolarHBondContact N-OD1 2.79Å; Y76-N91 PolarHBondContact O-ND2 2.98Å; Y76-F96 HydrophobicContact CD2-CE1 4.4Å; Y76-F96 HydrophobicContact CE2-CD1 4.16Å; Y76-F96 AromaticContact CE2-CE1 3.51Å; Y76-F96 HydrophobicContact CE2-CE1 3.51Å; Y76-F96 HydrophobicContact CE2-CZ 4.5Å; Y76-F96 AromaticContact CZ-CE1 3.88Å; Y76-L97 HydrophobicContact CD2-CD1 4.11Å; Y76-R100 HydrophobicContact CE2-CG 3.83Å; Y76-R100 VanDerWaalsContact OH-CD 3.24Å; Y76-R100 WeakPolarHBondContact OH-CD 3.03Å; Y76-R100 WeakPolarHBondContact OH-CG 3.36Å
77	R	98.8	Very high	98.5	Very high	150 Å²	150	53.3 Å²	53.3	57%	0.566	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.9	171	-66.9	-63	-175.3	118.6	-5.4	109.3	R68 V73 E75 V79	R68-R77 PolarHBondContact N-O 3.29Å; R68-R77 PolarHBondContact O-N 3Å; V73-R77 HydrophobicContact CG1-CG 4.5Å; E75-R77 IonicContact OE1-CZ 2.62Å; E75-R77 IonicContact OE1-NE 2.71Å; E75-R77 PolarHBondContact OE1-NE 2.97Å; E75-R77 IonicContact OE1-NH2 3.44Å; E75-R77 PolarHBondContact OE1-NH2 3.29Å; R77-V79 PolarHBondContact O-N 3Å
78	A	98.5	Very high	98.5	Very high	44 Å²	44	59.3 Å²	59.3	36%	0.364	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	125.1	167.2	0	0	0	0	0	108.6	R84 A87	A78-R84 HydrophobicContact CB-CB 4.32Å; A78-A87 HydrophobicContact CB-CB 4.26Å
79	V	98.6	Very high	98.5	Very high	65 Å²	65	62.3 Å²	62.3	39%	0.394	32%	0.315	S	S	.	.	S	Bend	trans	-87.8	-35	174.2	177.2	0	0	0	0	109.4	E65 Y66 R68 R77	E65-V79 HydrophobicContact CB-CG1 4.3Å; E65-V79 HydrophobicContact CG-CB 4.32Å; E65-V79 HydrophobicContact CG-CG1 4.35Å; E65-V79 HydrophobicContact CG-CG2 4.04Å; E65-V79 WeakPolarHBondContact O-CB 3.33Å; E65-V79 VanDerWaalsContact O-CG1 3.25Å; E65-V79 WeakPolarHBondContact O-CG1 3.46Å; Y66-V79 PolarHBondContact O-N 3.39Å; R68-V79 HydrophobicContact CB-CG2 4.09Å; R77-V79 PolarHBondContact O-N 3Å
80	T	98.4	Very high	98.4	Very high	36 Å²	36	64 Å²	64	22%	0.221	32%	0.322	C	S	.	.	S	Bend	trans	-131.5	169.5	169.8	73.7	0	0	0	0	110.8	E64 Y66 L82 G83	E64-T80 HydrophobicContact CG-CG2 3.92Å; E64-T80 WeakPolarHBondContact OE1-CB 3.35Å; E64-T80 WeakPolarHBondContact OE1-CG2 3.43Å; E64-T80 PolarHBondContact OE1-OG1 3.31Å; Y66-T80 PolarHBondContact O-N 3.05Å; T80-L82 PolarHBondContact O-N 3.37Å; T80-L82 VanDerWaalsContact O-N 3.15Å; T80-G83 PolarHBondContact O-N 3.47Å; T80-G83 VanDerWaalsContact O-N 3.08Å
81	E	98	Very high	98.4	Very high	132 Å²	132	65.5 Å²	65.5	62%	0.617	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-58.5	-28.7	-177.2	-69.9	-60.2	149	0	0	113.1	G83 R84	E81-G83 PolarHBondContact O-N 2.97Å; E81-R84 WeakPolarHBondContact O-CB 3.44Å; E81-R84 PolarHBondContact O-N 2.79Å; E81-R84 IonicContact OE1-CZ 3.73Å; E81-R84 IonicContact OE1-NH2 3.4Å; E81-R84 PolarHBondContact OE1-NH2 2.71Å; E81-R84 IonicContact OE2-CZ 3.18Å; E81-R84 IonicContact OE2-NE 3.6Å; E81-R84 PolarHBondContact OE2-NE 3.02Å; E81-R84 IonicContact OE2-NH2 3.68Å; E81-R84 PolarHBondContact OE2-NH2 3.35Å
82	L	98	Very high	98.4	Very high	95 Å²	95	68.4 Å²	68.4	50%	0.497	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-57.7	-36	177.3	-180	64.3	0	0	0	111.9	Y61 Y66 T80 P85	Y61-L82 HydrophobicContact CG-CD2 4.36Å; Y66-L82 HydrophobicContact CD1-CD2 4.26Å; Y66-L82 HydrophobicContact CD2-CG 4.45Å; Y66-L82 HydrophobicContact CG-CD2 4.1Å; Y66-L82 HydrophobicContact CG-CG 4.28Å; T80-L82 PolarHBondContact O-N 3.37Å; T80-L82 VanDerWaalsContact O-N 3.15Å; L82-P85 WeakPolarHBondContact O-CD 3.43Å
83	G	98.5	Very high	98.4	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-90.8	1	-177.4	0	0	0	0	0	116.1	Y66 T80 E81 D86 A87	Y66-G83 WeakPolarHBondContact O-CA 3.01Å; T80-G83 PolarHBondContact O-N 3.47Å; T80-G83 VanDerWaalsContact O-N 3.08Å; E81-G83 PolarHBondContact O-N 2.97Å; G83-D86 PolarHBondContact O-N 2.8Å; G83-A87 WeakPolarHBondContact O-CB 3.36Å; G83-A87 PolarHBondContact O-N 2.88Å
84	R	98.6	Very high	98.3	Very high	120 Å²	120	71.1 Å²	71.1	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-56.8	-47.7	177.3	-177.2	-170.1	-65	-100.5	0.5	112.4	A78 E81 D86 A87 E88	A78-R84 HydrophobicContact CB-CB 4.32Å; E81-R84 WeakPolarHBondContact O-CB 3.44Å; E81-R84 PolarHBondContact O-N 2.79Å; E81-R84 IonicContact OE1-CZ 3.73Å; E81-R84 IonicContact OE1-NH2 3.4Å; E81-R84 PolarHBondContact OE1-NH2 2.71Å; E81-R84 IonicContact OE2-CZ 3.18Å; E81-R84 IonicContact OE2-NE 3.6Å; E81-R84 PolarHBondContact OE2-NE 3.02Å; E81-R84 IonicContact OE2-NH2 3.68Å; E81-R84 PolarHBondContact OE2-NH2 3.35Å; R84-D86 VanDerWaalsContact C-N 3.32Å; R84-D86 PolarHBondContact O-N 3.1Å; R84-A87 PolarHBondContact O-N 2.88Å; R84-E88 WeakPolarHBondContact CG-OE1 3.27Å; R84-E88 WeakPolarHBondContact O-CG 3.43Å; R84-E88 PolarHBondContact O-N 2.97Å; R84-E88 VanDerWaalsContact O-N 3.14Å
85	P	98.6	Very high	98.3	Very high	78 Å²	78	76.9 Å²	76.9	51%	0.506	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-40.5	179.4	-21.3	34.5	0	0	0	112.5	L82 Y89	L82-P85 WeakPolarHBondContact O-CD 3.43Å; P85-Y89 VanDerWaalsContact O-CB 3.27Å; P85-Y89 WeakPolarHBondContact O-CB 3.4Å; P85-Y89 PolarHBondContact O-N 2.91Å
86	D	98.4	Very high	98.3	Very high	49 Å²	49	76.4 Å²	76.4	26%	0.262	38%	0.378	S	S	.	.	H	α-helix	trans	-69	-44.4	-178.7	-62.7	-42.1	0	0	0	111.7	Y66 V67 G83 R84 E88 Y89 W90	Y66-D86 WeakPolarHBondContact CE2-OD2 3.37Å; V67-D86 HydrophobicContact CG1-CB 4.41Å; G83-D86 PolarHBondContact O-N 2.8Å; R84-D86 VanDerWaalsContact C-N 3.32Å; R84-D86 PolarHBondContact O-N 3.1Å; D86-E88 PolarHBondContact O-N 2.68Å; D86-Y89 PolarHBondContact O-N 3Å; D86-W90 HydrophobicContact CB-CD2 4.26Å; D86-W90 HydrophobicContact CB-CE3 4.24Å; D86-W90 HydrophobicContact CB-CH2 4.14Å; D86-W90 HydrophobicContact CB-CZ2 4.12Å; D86-W90 HydrophobicContact CB-CZ3 4.2Å; D86-W90 VanDerWaalsContact O-CB 3.26Å; D86-W90 WeakPolarHBondContact O-CB 3.37Å; D86-W90 VanDerWaalsContact O-CG 3.23Å; D86-W90 PolarHBondContact O-N 3.15Å
87	A	98.6	Very high	98.2	Very high	8 Å²	8	77 Å²	77	7%	0.066	38%	0.381	C	S	.	.	H	α-helix	trans	-59.6	-45.6	177.1	0	0	0	0	0	111.6	V67 A78 G83 R84 N91	V67-A87 HydrophobicContact CG2-CB 3.98Å; A78-A87 HydrophobicContact CB-CB 4.26Å; G83-A87 WeakPolarHBondContact O-CB 3.36Å; G83-A87 PolarHBondContact O-N 2.88Å; R84-A87 PolarHBondContact O-N 2.88Å; A87-N91 WeakPolarHBondContact O-CB 3.36Å; A87-N91 PolarHBondContact O-N 3.12Å; A87-N91 PolarHBondContact O-ND2 3.3Å; A87-N91 VanDerWaalsContact O-ND2 3.08Å
88	E	98.3	Very high	98.2	Very high	126 Å²	126	73.8 Å²	73.8	59%	0.589	37%	0.373	S	S	*	.	H	α-helix	trans	-62.9	-47.3	177.4	-71.6	174.2	-170.3	0	0	111.5	R84 D86 S92	R84-E88 WeakPolarHBondContact CG-OE1 3.27Å; R84-E88 WeakPolarHBondContact O-CG 3.43Å; R84-E88 PolarHBondContact O-N 2.97Å; R84-E88 VanDerWaalsContact O-N 3.14Å; D86-E88 PolarHBondContact O-N 2.68Å; E88-S92 PolarHBondContact O-N 3.21Å
89	Y	98.5	Very high	98.2	Very high	139 Å²	139	76.8 Å²	76.8	55%	0.545	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-46.6	-178.5	179.1	-118.7	0	0	0	112.6	P85 D86 S92 Q93	P85-Y89 VanDerWaalsContact O-CB 3.27Å; P85-Y89 WeakPolarHBondContact O-CB 3.4Å; P85-Y89 PolarHBondContact O-N 2.91Å; D86-Y89 PolarHBondContact O-N 3Å; Y89-S92 PolarHBondContact O-N 2.92Å; Y89-S92 PolarHBondContact O-OG 3.11Å; Y89-Q93 PolarHBondContact O-NE2 2.97Å
90	W	98.5	Very high	98.1	Very high	36 Å²	36	75.4 Å²	75.4	14%	0.136	37%	0.37	C	S	.	.	H	α-helix	trans	-70.2	-38.4	-178.9	-67	-15.8	0	0	0	112.6	Y59 V67 Y76 D86 S92 Q93 F96	Y59-W90 HydrophobicContact CD1-CH2 4.11Å; Y59-W90 HydrophobicContact CD2-CH2 4.05Å; Y59-W90 AromaticContact CD2-CZ3 3.97Å; Y59-W90 HydrophobicContact CD2-CZ3 3.97Å; Y59-W90 AromaticContact CE1-CH2 3.98Å; Y59-W90 HydrophobicContact CE1-CH2 3.98Å; Y59-W90 AromaticContact CE2-CH2 3.95Å; Y59-W90 HydrophobicContact CE2-CH2 3.95Å; Y59-W90 AromaticContact CE2-CZ3 3.85Å; Y59-W90 HydrophobicContact CE2-CZ3 3.85Å; Y59-W90 HydrophobicContact CG-CH2 4.17Å; Y59-W90 HydrophobicContact CG-CZ3 4.5Å; Y59-W90 AromaticContact CZ-CH2 3.93Å; V67-W90 HydrophobicContact CG1-CH2 4.01Å; V67-W90 HydrophobicContact CG1-CZ3 3.59Å; V67-W90 HydrophobicContact CG2-CE3 4.47Å; V67-W90 HydrophobicContact CG2-CZ3 4.22Å; Y76-W90 AromaticContact CD1-CE3 3.41Å; Y76-W90 HydrophobicContact CD1-CE3 3.41Å; Y76-W90 VanDerWaalsContact CD1-CE3 3.41Å; Y76-W90 AromaticContact CD1-CZ3 3.71Å; Y76-W90 HydrophobicContact CD1-CZ3 3.71Å; Y76-W90 HydrophobicContact CD2-CB 3.96Å; Y76-W90 HydrophobicContact CD2-CE3 4.11Å; Y76-W90 AromaticContact CE1-CE3 3.39Å; Y76-W90 HydrophobicContact CE1-CE3 3.39Å; Y76-W90 AromaticContact CE1-CZ3 3.51Å; Y76-W90 HydrophobicContact CE1-CZ3 3.51Å; Y76-W90 HydrophobicContact CE2-CB 4.24Å; Y76-W90 HydrophobicContact CE2-CE3 4.12Å; Y76-W90 HydrophobicContact CG-CB 4.42Å; Y76-W90 AromaticContact CG-CE3 3.76Å; Y76-W90 HydrophobicContact CG-CE3 3.76Å; Y76-W90 HydrophobicContact CG-CZ3 4.49Å; Y76-W90 AromaticContact CZ-CE3 3.74Å; D86-W90 HydrophobicContact CB-CD2 4.26Å; D86-W90 HydrophobicContact CB-CE3 4.24Å; D86-W90 HydrophobicContact CB-CH2 4.14Å; D86-W90 HydrophobicContact CB-CZ2 4.12Å; D86-W90 HydrophobicContact CB-CZ3 4.2Å; D86-W90 VanDerWaalsContact O-CB 3.26Å; D86-W90 WeakPolarHBondContact O-CB 3.37Å; D86-W90 VanDerWaalsContact O-CG 3.23Å; D86-W90 PolarHBondContact O-N 3.15Å; W90-S92 PolarHBondContact O-N 3.37Å; W90-Q93 PolarHBondContact O-N 3.32Å; W90-F96 HydrophobicContact CB-CD1 3.94Å; W90-F96 HydrophobicContact CB-CE1 3.59Å; W90-F96 HydrophobicContact CB-CZ 4.44Å; W90-F96 HydrophobicContact CD2-CE1 4.07Å; W90-F96 HydrophobicContact CD2-CZ 4.2Å; W90-F96 HydrophobicContact CG-CD1 4.32Å; W90-F96 AromaticContact CG-CE1 3.6Å; W90-F96 HydrophobicContact CG-CE1 3.6Å; W90-F96 AromaticContact CG-CZ 3.99Å; W90-F96 HydrophobicContact CG-CZ 3.99Å
91	N	98.6	Very high	98.1	Very high	43 Å²	43	78.3 Å²	78.3	23%	0.23	38%	0.377	C	S	.	.	H	α-helix	trans	-68.5	-24.1	175.9	-69.1	-20.6	0	0	0	112.7	Y76 A87 Q93 L97	Y76-N91 WeakPolarHBondContact CB-OD1 3.28Å; Y76-N91 PolarHBondContact N-OD1 2.79Å; Y76-N91 PolarHBondContact O-ND2 2.98Å; A87-N91 WeakPolarHBondContact O-CB 3.36Å; A87-N91 PolarHBondContact O-N 3.12Å; A87-N91 PolarHBondContact O-ND2 3.3Å; A87-N91 VanDerWaalsContact O-ND2 3.08Å; N91-Q93 PolarHBondContact O-N 2.95Å; N91-L97 WeakPolarHBondContact OD1-CD1 3.43Å
92	S	98.2	Very high	98.2	Very high	88 Å²	88	73.9 Å²	73.9	62%	0.615	36%	0.363	S	S	*	.	H	α-helix	trans	-71.4	-19	174.6	80.5	0	0	0	0	113.7	E88 Y89 W90 K94	E88-S92 PolarHBondContact O-N 3.21Å; Y89-S92 PolarHBondContact O-N 2.92Å; Y89-S92 PolarHBondContact O-OG 3.11Å; W90-S92 PolarHBondContact O-N 3.37Å; S92-K94 PolarHBondContact O-N 3.38Å
93	Q	98.3	Very high	98.2	Very high	65 Å²	65	71.4 Å²	71.4	30%	0.304	35%	0.35	S	S	.	.			trans	-93.8	98.5	-179.1	-68.2	177.2	68.9	0	0	109.9	Y89 W90 N91 D95 F96 L97	Y89-Q93 PolarHBondContact O-NE2 2.97Å; W90-Q93 PolarHBondContact O-N 3.32Å; N91-Q93 PolarHBondContact O-N 2.95Å; Q93-D95 PolarHBondContact O-N 2.66Å; Q93-F96 HydrophobicContact CB-CB 3.57Å; Q93-F96 HydrophobicContact CB-CG 4.37Å; Q93-F96 WeakPolarHBondContact O-CB 3.49Å; Q93-F96 PolarHBondContact O-N 2.8Å; Q93-L97 PolarHBondContact O-N 2.84Å
94	K	96.6	Very high	98.2	Very high	153 Å²	153	72.1 Å²	72.1	67%	0.665	35%	0.354	S	S	*	.	H	α-helix	trans	-59.7	-49.4	-173.2	-172.1	176.3	-179.7	-178.8	0	113.2	S92 F96 L97 E98	S92-K94 PolarHBondContact O-N 3.38Å; K94-F96 PolarHBondContact O-N 2.87Å; K94-L97 PolarHBondContact O-N 2.76Å; K94-L97 VanDerWaalsContact O-N 3.08Å; K94-E98 HydrophobicContact CG-CG 4.46Å; K94-E98 WeakPolarHBondContact O-CG 3.31Å; K94-E98 PolarHBondContact O-N 2.84Å
95	D	97.8	Very high	98.2	Very high	131 Å²	131	70.8 Å²	70.8	70%	0.701	36%	0.356	S	S	*	.	H	α-helix	trans	-61.8	-38.5	-179	-57.1	-19.5	0	0	0	110.4	Q93 L97 E98 D99	Q93-D95 PolarHBondContact O-N 2.66Å; D95-L97 PolarHBondContact O-N 2.82Å; D95-E98 PolarHBondContact O-N 3.03Å; D95-D99 PolarHBondContact O-N 3.1Å
96	F	97.4	Very high	98.2	Very high	45 Å²	45	71.3 Å²	71.3	20%	0.197	36%	0.358	C	S	.	.	H	α-helix	trans	-60.1	-48.7	173.8	-172.6	-87.4	0	0	0	110.7	Y76 W90 Q93 K94 E98 D99 R100	Y76-F96 HydrophobicContact CD2-CE1 4.4Å; Y76-F96 HydrophobicContact CE2-CD1 4.16Å; Y76-F96 AromaticContact CE2-CE1 3.51Å; Y76-F96 HydrophobicContact CE2-CE1 3.51Å; Y76-F96 HydrophobicContact CE2-CZ 4.5Å; Y76-F96 AromaticContact CZ-CE1 3.88Å; W90-F96 HydrophobicContact CB-CD1 3.94Å; W90-F96 HydrophobicContact CB-CE1 3.59Å; W90-F96 HydrophobicContact CB-CZ 4.44Å; W90-F96 HydrophobicContact CD2-CE1 4.07Å; W90-F96 HydrophobicContact CD2-CZ 4.2Å; W90-F96 HydrophobicContact CG-CD1 4.32Å; W90-F96 AromaticContact CG-CE1 3.6Å; W90-F96 HydrophobicContact CG-CE1 3.6Å; W90-F96 AromaticContact CG-CZ 3.99Å; W90-F96 HydrophobicContact CG-CZ 3.99Å; Q93-F96 HydrophobicContact CB-CB 3.57Å; Q93-F96 HydrophobicContact CB-CG 4.37Å; Q93-F96 WeakPolarHBondContact O-CB 3.49Å; Q93-F96 PolarHBondContact O-N 2.8Å; K94-F96 PolarHBondContact O-N 2.87Å; F96-E98 PolarHBondContact O-N 2.8Å; F96-D99 PolarHBondContact O-N 3.46Å; F96-R100 VanDerWaalsContact CD1-NH2 3.33Å; F96-R100 VanDerWaalsContact CE2-NH2 3.32Å; F96-R100 PolarHBondContact O-N 2.98Å; F96-R100 PolarHBondContact O-NE 3.45Å; F96-R100 PolarHBondContact O-NH2 2.83Å
97	L	97.9	Very high	98.1	Very high	13 Å²	13	74 Å²	74	7%	0.068	37%	0.365	C	S	.	.	H	α-helix	trans	-65.5	-39.6	-178.3	-157.8	61.8	0	0	0	113	F69 E75 Y76 N91 Q93 K94 D95 R100 R101	F69-L97 HydrophobicContact CD2-CD1 4.27Å; F69-L97 HydrophobicContact CE2-CD1 4.1Å; E75-L97 HydrophobicContact CB-CD1 4.15Å; E75-L97 HydrophobicContact CB-CD2 4.23Å; Y76-L97 HydrophobicContact CD2-CD1 4.11Å; N91-L97 WeakPolarHBondContact OD1-CD1 3.43Å; Q93-L97 PolarHBondContact O-N 2.84Å; K94-L97 PolarHBondContact O-N 2.76Å; K94-L97 VanDerWaalsContact O-N 3.08Å; D95-L97 PolarHBondContact O-N 2.82Å; L97-R100 WeakPolarHBondContact O-CB 3.25Å; L97-R100 PolarHBondContact O-N 2.82Å; L97-R101 VanDerWaalsContact CD2-NH2 3.3Å; L97-R101 WeakPolarHBondContact O-CG 3.22Å; L97-R101 PolarHBondContact O-N 2.83Å
98	E	98.1	Very high	98.2	Very high	84 Å²	84	73.6 Å²	73.6	39%	0.393	36%	0.362	S	S	.	.	H	α-helix	trans	-65.1	-41.8	176.9	-67.1	-53.9	141.4	0	0	112.3	K94 D95 F96 R100 R101 A102	K94-E98 HydrophobicContact CG-CG 4.46Å; K94-E98 WeakPolarHBondContact O-CG 3.31Å; K94-E98 PolarHBondContact O-N 2.84Å; D95-E98 PolarHBondContact O-N 3.03Å; F96-E98 PolarHBondContact O-N 2.8Å; E98-R100 VanDerWaalsContact C-N 3.25Å; E98-R100 PolarHBondContact O-N 2.78Å; E98-R101 WeakPolarHBondContact O-CB 3.43Å; E98-R101 PolarHBondContact O-N 3.36Å; E98-R101 VanDerWaalsContact O-N 3.17Å; E98-R101 IonicContact OE1-CZ 3.66Å; E98-R101 IonicContact OE1-NH1 3.81Å; E98-R101 PolarHBondContact OE1-NH1 3.46Å; E98-A102 PolarHBondContact O-N 3.32Å
99	D	97.8	Very high	98.2	Very high	106 Å²	106	71.1 Å²	71.1	57%	0.567	35%	0.347	S	S	*	.	H	α-helix	trans	-57.2	-41.7	173.9	-76.3	-16.1	0	0	0	111.4	D95 F96 A102 L103	D95-D99 PolarHBondContact O-N 3.1Å; F96-D99 PolarHBondContact O-N 3.46Å; D99-A102 PolarHBondContact O-N 3.06Å; D99-L103 WeakPolarHBondContact O-CG 3.49Å; D99-L103 PolarHBondContact O-N 2.76Å
100	R	98.1	Very high	98.2	Very high	36 Å²	36	69.8 Å²	69.8	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-43.4	177	-111.7	62.7	58.1	-178.8	-35.2	112.4	F69 Y76 F96 L97 E98 A102 L103	F69-R100 HydrophobicContact CB-CG 4.4Å; F69-R100 HydrophobicContact CD1-CB 4.24Å; F69-R100 HydrophobicContact CD1-CG 4.11Å; F69-R100 HydrophobicContact CD2-CB 3.9Å; F69-R100 HydrophobicContact CD2-CG 3.99Å; F69-R100 HydrophobicContact CE1-CB 4.04Å; F69-R100 HydrophobicContact CE1-CG 4.4Å; F69-R100 HydrophobicContact CE2-CB 3.68Å; F69-R100 HydrophobicContact CE2-CG 4.29Å; F69-R100 HydrophobicContact CG-CB 4.19Å; F69-R100 HydrophobicContact CG-CG 3.91Å; F69-R100 HydrophobicContact CZ-CB 3.77Å; F69-R100 HydrophobicContact CZ-CG 4.5Å; Y76-R100 HydrophobicContact CE2-CG 3.83Å; Y76-R100 VanDerWaalsContact OH-CD 3.24Å; Y76-R100 WeakPolarHBondContact OH-CD 3.03Å; Y76-R100 WeakPolarHBondContact OH-CG 3.36Å; F96-R100 VanDerWaalsContact CD1-NH2 3.33Å; F96-R100 VanDerWaalsContact CE2-NH2 3.32Å; F96-R100 PolarHBondContact O-N 2.98Å; F96-R100 PolarHBondContact O-NE 3.45Å; F96-R100 PolarHBondContact O-NH2 2.83Å; L97-R100 WeakPolarHBondContact O-CB 3.25Å; L97-R100 PolarHBondContact O-N 2.82Å; E98-R100 VanDerWaalsContact C-N 3.25Å; E98-R100 PolarHBondContact O-N 2.78Å; R100-A102 PolarHBondContact O-N 2.95Å; R100-L103 HydrophobicContact CG-CD1 4.36Å; R100-L103 WeakPolarHBondContact O-CB 3.45Å; R100-L103 PolarHBondContact O-N 2.83Å
101	R	98.4	Very high	98.2	Very high	98 Å²	98	71.3 Å²	71.3	37%	0.37	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-36.1	176.7	-69.9	166.2	-179.6	178.7	-3.4	111.5	F69 G74 L97 E98 L103	F69-R101 HydrophobicContact CE2-CG 4.27Å; F69-R101 HydrophobicContact CZ-CG 3.9Å; G74-R101 VanDerWaalsContact O-CZ 3.29Å; G74-R101 PolarHBondContact O-NE 3.27Å; G74-R101 PolarHBondContact O-NH2 3.06Å; L97-R101 VanDerWaalsContact CD2-NH2 3.3Å; L97-R101 WeakPolarHBondContact O-CG 3.22Å; L97-R101 PolarHBondContact O-N 2.83Å; E98-R101 WeakPolarHBondContact O-CB 3.43Å; E98-R101 PolarHBondContact O-N 3.36Å; E98-R101 VanDerWaalsContact O-N 3.17Å; E98-R101 IonicContact OE1-CZ 3.66Å; E98-R101 IonicContact OE1-NH1 3.81Å; E98-R101 PolarHBondContact OE1-NH1 3.46Å; R101-L103 VanDerWaalsContact C-N 3.29Å; R101-L103 PolarHBondContact O-N 3.04Å
102	A	98.4	Very high	98.2	Very high	39 Å²	39	71 Å²	71	32%	0.322	35%	0.353	S	S	.	.	H	α-helix	trans	-72.2	-16.8	178.9	0	0	0	0	0	114.3	E98 D99 R100 V104 D105 T106	E98-A102 PolarHBondContact O-N 3.32Å; D99-A102 PolarHBondContact O-N 3.06Å; R100-A102 PolarHBondContact O-N 2.95Å; A102-V104 PolarHBondContact O-N 3Å; A102-V104 VanDerWaalsContact O-N 3.13Å; A102-D105 PolarHBondContact O-N 3.04Å; A102-T106 HydrophobicContact CB-CG2 4.25Å; A102-T106 PolarHBondContact O-N 2.84Å; A102-T106 PolarHBondContact O-OG1 2.89Å; A102-T106 VanDerWaalsContact O-OG1 3.13Å
103	L	98.3	Very high	98.2	Very high	42 Å²	42	69.2 Å²	69.2	22%	0.22	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-21.7	-176.3	-69.2	175.3	0	0	0	114	F55 D99 R100 R101 D105 Y107 C108	F55-L103 HydrophobicContact CD1-CB 3.82Å; F55-L103 HydrophobicContact CD1-CD1 4.12Å; F55-L103 HydrophobicContact CE1-CB 3.88Å; F55-L103 HydrophobicContact CE1-CD1 3.33Å; F55-L103 HydrophobicContact CE1-CG 4.24Å; F55-L103 HydrophobicContact CG-CB 4.19Å; F55-L103 HydrophobicContact CZ-CB 4.29Å; F55-L103 HydrophobicContact CZ-CD1 3.58Å; D99-L103 WeakPolarHBondContact O-CG 3.49Å; D99-L103 PolarHBondContact O-N 2.76Å; R100-L103 HydrophobicContact CG-CD1 4.36Å; R100-L103 WeakPolarHBondContact O-CB 3.45Å; R100-L103 PolarHBondContact O-N 2.83Å; R101-L103 VanDerWaalsContact C-N 3.29Å; R101-L103 PolarHBondContact O-N 3.04Å; L103-D105 PolarHBondContact O-N 2.96Å; L103-Y107 WeakPolarHBondContact O-CA 3.38Å; L103-Y107 WeakPolarHBondContact O-CB 3.33Å; L103-Y107 PolarHBondContact O-N 2.97Å; L103-Y107 VanDerWaalsContact O-N 3.11Å; L103-C108 PolarHBondContact O-N 3.31Å
104	V	98.5	Very high	98.1	Very high	16 Å²	16	70.3 Å²	70.3	10%	0.097	36%	0.358	C	S	.	.	I	π-helix	trans	-57	-39.5	171.7	-174.6	0	0	0	0	110.7	V53 F55 S71 A102 C108 R109	V53-V104 HydrophobicContact CB-CG1 3.62Å; V53-V104 HydrophobicContact CG1-CG1 3.78Å; F55-V104 HydrophobicContact CB-CG2 4Å; S71-V104 VanDerWaalsContact CB-CG2 3.47Å; A102-V104 PolarHBondContact O-N 3Å; A102-V104 VanDerWaalsContact O-N 3.13Å; V104-C108 WeakPolarHBondContact O-CB 3.46Å; V104-R109 WeakPolarHBondContact O-CG 3.46Å; V104-R109 PolarHBondContact O-N 2.86Å
105	D	98.5	Very high	98.2	Very high	92 Å²	92	63.4 Å²	63.4	49%	0.492	33%	0.331	S	S	.	.	I	π-helix	trans	-92.3	-55.1	179.3	-73.4	-61.7	0	0	0	112.3	A102 L103 Y107 R109 H110	A102-D105 PolarHBondContact O-N 3.04Å; L103-D105 PolarHBondContact O-N 2.96Å; D105-Y107 VanDerWaalsContact C-N 3.29Å; D105-Y107 PolarHBondContact O-N 2.85Å; D105-R109 VanDerWaalsContact CG-NH1 3.26Å; D105-R109 WeakPolarHBondContact OD1-CD 3.43Å; D105-R109 IonicContact OD1-CZ 3.63Å; D105-R109 IonicContact OD1-NE 3.22Å; D105-R109 IonicContact OD1-NH1 2.84Å; D105-R109 PolarHBondContact OD1-NH1 2.75Å; D105-R109 IonicContact OD2-NH1 3.74Å; D105-R109 PolarHBondContact OD2-NH1 3.42Å; D105-H110 PolarHBondContact O-N 3.18Å; D105-H110 VanDerWaalsContact O-N 3.15Å
106	T	98.2	Very high	98.2	Very high	89 Å²	89	60.4 Å²	60.4	55%	0.546	31%	0.313	S	S	.	.	I	π-helix	trans	-71.1	-26.2	-169.3	61.2	0	0	0	0	112.8	A102 H110	A102-T106 HydrophobicContact CB-CG2 4.25Å; A102-T106 PolarHBondContact O-N 2.84Å; A102-T106 PolarHBondContact O-OG1 2.89Å; A102-T106 VanDerWaalsContact O-OG1 3.13Å; T106-H110 VanDerWaalsContact O-CB 3.26Å; T106-H110 WeakPolarHBondContact O-CB 3.47Å
107	Y	98.3	Very high	98.2	Very high	104 Å²	104	62.6 Å²	62.6	41%	0.408	33%	0.333	S	S	.	.	I	π-helix	trans	-110.5	-60.2	178.4	-177.5	-100.6	0	0	0	111.4	F55 L103 D105 N111	F55-Y107 HydrophobicContact CE2-CD1 4.17Å; F55-Y107 HydrophobicContact CE2-CE1 4.4Å; L103-Y107 WeakPolarHBondContact O-CA 3.38Å; L103-Y107 WeakPolarHBondContact O-CB 3.33Å; L103-Y107 PolarHBondContact O-N 2.97Å; L103-Y107 VanDerWaalsContact O-N 3.11Å; D105-Y107 VanDerWaalsContact C-N 3.29Å; D105-Y107 PolarHBondContact O-N 2.85Å; Y107-N111 WeakPolarHBondContact CD2-ND2 3.39Å; Y107-N111 WeakPolarHBondContact CE2-ND2 3.4Å; Y107-N111 WeakPolarHBondContact O-CB 3.24Å; Y107-N111 PolarHBondContact O-N 2.02Å; Y107-N111 PolarHBondContact O-ND2 2.91Å
108	C	98.7	Very high	98.1	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.007	35%	0.354	C	S	.	.	I	π-helix	trans	-68.5	-57.9	-171.6	-62.7	0	0	0	0	113	C44 F46 V53 F55 L103 V104 H110 N111 Y112	C44-C108 HydrophobicContact CB-CB 3.64Å; C44-C108 WeakPolarHBondContact CB-SG 3.47Å; C44-C108 WeakPolarHBondContact SG-CA 3.42Å; C44-C108 WeakPolarHBondContact SG-CB 3.24Å; C44-C108 CovalentContact SG-SG 2.04Å; C44-C108 PolarHBondContact SG-SG 3.41Å; F46-C108 HydrophobicContact CE1-CB 4.18Å; F46-C108 HydrophobicContact CZ-CB 4.05Å; F46-C108 WeakPolarHBondContact CZ-O 3.36Å; V53-C108 HydrophobicContact CG1-CB 3.55Å; F55-C108 VanDerWaalsContact CD2-SG 3.55Å; L103-C108 PolarHBondContact O-N 3.31Å; V104-C108 WeakPolarHBondContact O-CB 3.46Å; C108-H110 VanDerWaalsContact C-N 3.33Å; C108-H110 PolarHBondContact O-N 2.85Å; C108-N111 PolarHBondContact O-N 2.91Å; C108-Y112 WeakPolarHBondContact O-CB 3.08Å; C108-Y112 PolarHBondContact O-N 2.88Å
109	R	98.7	Very high	98.1	Very high	73 Å²	73	65.2 Å²	65.2	28%	0.275	35%	0.346	S	S	.	.	I	π-helix	trans	-64.2	-39.4	179.6	-70.5	-169.9	-177.5	94.3	2.1	112	T50 V53 V104 D105 Y112 G113	T50-R109 HydrophobicContact CG2-CG 4.43Å; T50-R109 PolarHBondContact O-NE 3.05Å; V53-R109 HydrophobicContact CG2-CG 3.95Å; V104-R109 WeakPolarHBondContact O-CG 3.46Å; V104-R109 PolarHBondContact O-N 2.86Å; D105-R109 VanDerWaalsContact CG-NH1 3.26Å; D105-R109 WeakPolarHBondContact OD1-CD 3.43Å; D105-R109 IonicContact OD1-CZ 3.63Å; D105-R109 IonicContact OD1-NE 3.22Å; D105-R109 IonicContact OD1-NH1 2.84Å; D105-R109 PolarHBondContact OD1-NH1 2.75Å; D105-R109 IonicContact OD2-NH1 3.74Å; D105-R109 PolarHBondContact OD2-NH1 3.42Å; R109-Y112 PolarHBondContact O-N 3.16Å; R109-G113 PolarHBondContact O-N 2.88Å
110	H	98.3	Very high	98.1	Very high	112 Å²	112	62.9 Å²	62.9	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-55.8	-55.6	173.9	179.5	74.6	0	0	0	112	D105 T106 C108 Y112 G113 V114	D105-H110 PolarHBondContact O-N 3.18Å; D105-H110 VanDerWaalsContact O-N 3.15Å; T106-H110 VanDerWaalsContact O-CB 3.26Å; T106-H110 WeakPolarHBondContact O-CB 3.47Å; C108-H110 VanDerWaalsContact C-N 3.33Å; C108-H110 PolarHBondContact O-N 2.85Å; H110-Y112 VanDerWaalsContact C-N 3.33Å; H110-Y112 PolarHBondContact O-N 3.02Å; H110-G113 PolarHBondContact O-N 2.79Å; H110-G113 VanDerWaalsContact O-N 3.15Å; H110-V114 WeakPolarHBondContact O-CG2 3.46Å; H110-V114 PolarHBondContact O-N 2.85Å
111	N	98.6	Very high	98	Very high	67 Å²	67	66.5 Å²	66.5	36%	0.358	35%	0.354	S	S	.	.	H	α-helix	trans	-67.8	-32.6	-177.7	-72.3	-32.4	0	0	0	112.8	Y107 C108 G113 V114 G115	Y107-N111 WeakPolarHBondContact CD2-ND2 3.39Å; Y107-N111 WeakPolarHBondContact CE2-ND2 3.4Å; Y107-N111 WeakPolarHBondContact O-CB 3.24Å; Y107-N111 PolarHBondContact O-N 2.02Å; Y107-N111 PolarHBondContact O-ND2 2.91Å; C108-N111 PolarHBondContact O-N 2.91Å; N111-G113 VanDerWaalsContact C-N 3.35Å; N111-V114 PolarHBondContact O-N 2.89Å; N111-G115 PolarHBondContact O-N 3.18Å
112	Y	98.5	Very high	98	Very high	38 Å²	38	65.9 Å²	65.9	15%	0.149	35%	0.352	C	S	.	.	H	α-helix	trans	-56.3	-51.6	170.1	-176.8	-78.1	0	0	0	110.2	F46 T50 C108 R109 H110 V114 G115 E116 V120	F46-Y112 HydrophobicContact CB-CE2 4.45Å; F46-Y112 AromaticContact CD1-CD2 3.57Å; F46-Y112 HydrophobicContact CD1-CD2 3.57Å; F46-Y112 HydrophobicContact CD1-CE2 4.23Å; F46-Y112 HydrophobicContact CD1-CG 4.24Å; F46-Y112 HydrophobicContact CD2-CD2 4.08Å; F46-Y112 AromaticContact CE1-CD2 3.69Å; F46-Y112 HydrophobicContact CE1-CD2 3.69Å; F46-Y112 HydrophobicContact CE1-CG 4.01Å; F46-Y112 HydrophobicContact CE2-CD2 4.16Å; F46-Y112 AromaticContact CG-CD2 3.79Å; F46-Y112 HydrophobicContact CG-CD2 3.79Å; F46-Y112 HydrophobicContact CG-CE2 4.2Å; F46-Y112 AromaticContact CZ-CD2 3.98Å; F46-Y112 HydrophobicContact CZ-CD2 3.98Å; F46-Y112 HydrophobicContact CZ-CG 4.37Å; T50-Y112 HydrophobicContact CG2-CD1 3.36Å; T50-Y112 HydrophobicContact CG2-CD2 3.9Å; T50-Y112 HydrophobicContact CG2-CE1 3.75Å; T50-Y112 HydrophobicContact CG2-CE2 4.22Å; T50-Y112 HydrophobicContact CG2-CG 3.46Å; T50-Y112 VanDerWaalsContact CG2-CG 3.46Å; C108-Y112 WeakPolarHBondContact O-CB 3.08Å; C108-Y112 PolarHBondContact O-N 2.88Å; R109-Y112 PolarHBondContact O-N 3.16Å; H110-Y112 VanDerWaalsContact C-N 3.33Å; H110-Y112 PolarHBondContact O-N 3.02Å; Y112-V114 VanDerWaalsContact C-N 3.34Å; Y112-V114 PolarHBondContact O-N 2.91Å; Y112-G115 PolarHBondContact O-N 3.41Å; Y112-E116 HydrophobicContact CD1-CB 4.37Å; Y112-E116 HydrophobicContact CE1-CB 4.21Å; Y112-E116 HydrophobicContact CE1-CG 4.07Å; Y112-E116 WeakPolarHBondContact O-CA 3Å; Y112-E116 VanDerWaalsContact O-CB 3.26Å; Y112-E116 WeakPolarHBondContact O-CB 3.47Å; Y112-E116 PolarHBondContact O-N 2.73Å; Y112-V120 HydrophobicContact CD2-CG2 4.4Å; Y112-V120 HydrophobicContact CE2-CG2 3.74Å
113	G	98.1	Very high	98	Very high	49 Å²	49	69.5 Å²	69.5	51%	0.505	36%	0.357	S	S	.	.	H	α-helix	trans	-61.9	-39.1	179.6	0	0	0	0	0	113.3	R109 H110 N111	R109-G113 PolarHBondContact O-N 2.88Å; H110-G113 PolarHBondContact O-N 2.79Å; H110-G113 VanDerWaalsContact O-N 3.15Å; N111-G113 VanDerWaalsContact C-N 3.35Å
114	V	98.2	Very high	98	Very high	88 Å²	88	69.4 Å²	69.4	53%	0.533	36%	0.358	S	S	.	.	H	α-helix	trans	-64	-42.9	175.3	173.9	0	0	0	0	111.4	H110 N111 Y112 F118	H110-V114 WeakPolarHBondContact O-CG2 3.46Å; H110-V114 PolarHBondContact O-N 2.85Å; N111-V114 PolarHBondContact O-N 2.89Å; Y112-V114 VanDerWaalsContact C-N 3.34Å; Y112-V114 PolarHBondContact O-N 2.91Å; V114-F118 WeakPolarHBondContact O-CE1 3.41Å
115	G	97.8	Very high	98	Very high	8 Å²	8	74.3 Å²	74.3	8%	0.082	38%	0.38	C	S	.	.	H	α-helix	trans	-87.8	-16.4	-174.1	0	0	0	0	0	115.6	N111 Y112 S117 F118 T119	N111-G115 PolarHBondContact O-N 3.18Å; Y112-G115 PolarHBondContact O-N 3.41Å; G115-S117 VanDerWaalsContact C-N 3.31Å; G115-S117 PolarHBondContact O-N 3.44Å; G115-F118 PolarHBondContact O-N 2.84Å; G115-T119 VanDerWaalsContact C-OG1 3.27Å; G115-T119 WeakPolarHBondContact O-CB 3.25Å; G115-T119 PolarHBondContact O-N 2.96Å; G115-T119 PolarHBondContact O-OG1 3.35Å
116	E	97.8	Very high	98	Very high	69 Å²	69	70.5 Å²	70.5	32%	0.322	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-45.8	-164.5	177.2	168.5	-149.4	0	0	112.9	Y112 F118 V120 Q121	Y112-E116 HydrophobicContact CD1-CB 4.37Å; Y112-E116 HydrophobicContact CE1-CB 4.21Å; Y112-E116 HydrophobicContact CE1-CG 4.07Å; Y112-E116 WeakPolarHBondContact O-CA 3Å; Y112-E116 VanDerWaalsContact O-CB 3.26Å; Y112-E116 WeakPolarHBondContact O-CB 3.47Å; Y112-E116 PolarHBondContact O-N 2.73Å; E116-F118 VanDerWaalsContact C-N 3.3Å; E116-F118 PolarHBondContact O-N 2.9Å; E116-V120 HydrophobicContact CG-CB 4.22Å; E116-V120 PolarHBondContact O-N 3.4Å; E116-V120 VanDerWaalsContact O-N 3.16Å; E116-Q121 HydrophobicContact CG-CG 3.99Å; E116-Q121 PolarHBondContact O-N 2.73Å
117	S	97.6	Very high	98	Very high	90 Å²	90	73.2 Å²	73.2	63%	0.629	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.3	-174.6	62	0	0	0	0	114	G115	G115-S117 VanDerWaalsContact C-N 3.31Å; G115-S117 PolarHBondContact O-N 3.44Å
118	F	96.3	Very high	98	Very high	117 Å²	117	69.4 Å²	69.4	51%	0.513	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-3.4	-174.9	64.6	-94.8	0	0	0	114.2	V114 G115 E116 R122	V114-F118 WeakPolarHBondContact O-CE1 3.41Å; G115-F118 PolarHBondContact O-N 2.84Å; E116-F118 VanDerWaalsContact C-N 3.3Å; E116-F118 PolarHBondContact O-N 2.9Å; F118-R122 WeakPolarHBondContact O-CB 3.48Å
119	T	97.4	Very high	97.9	Very high	35 Å²	35	72.2 Å²	72.2	22%	0.215	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-64.6	176.6	59.7	0	0	0	0	111.9	G115 R122 W182	G115-T119 VanDerWaalsContact C-OG1 3.27Å; G115-T119 WeakPolarHBondContact O-CB 3.25Å; G115-T119 PolarHBondContact O-N 2.96Å; G115-T119 PolarHBondContact O-OG1 3.35Å; T119-R122 WeakPolarHBondContact O-CB 3.27Å; T119-W182 HydrophobicContact CG2-CH2 3.78Å; T119-W182 HydrophobicContact CG2-CZ3 3.89Å
120	V	97.3	Very high	97.8	Very high	57 Å²	57	69.7 Å²	69.7	35%	0.345	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-47	-176	179.2	0	0	0	0	111.1	Y112 E116 R122	Y112-V120 HydrophobicContact CD2-CG2 4.4Å; Y112-V120 HydrophobicContact CE2-CG2 3.74Å; E116-V120 HydrophobicContact CG-CB 4.22Å; E116-V120 PolarHBondContact O-N 3.4Å; E116-V120 VanDerWaalsContact O-N 3.16Å; V120-R122 PolarHBondContact O-N 2.78Å
121	Q	97.2	Very high	97.5	Very high	113 Å²	113	68.9 Å²	68.9	53%	0.528	36%	0.355	S	S	.	.	S	Bend	trans	-83.5	-1.2	-178	-57	-57.8	-22.3	0	0	113	E116 R123	E116-Q121 HydrophobicContact CG-CG 3.99Å; E116-Q121 PolarHBondContact O-N 2.73Å; Q121-R123 PolarHBondContact O-N 3.45Å
122	R	97.9	Very high	97.3	Very high	85 Å²	85	67.5 Å²	67.5	32%	0.321	35%	0.349	S	S	.	.			trans	-61.9	128	179.7	-177	-179.5	175.7	84.2	-1.9	110.2	F118 T119 V120 V124 Y152	F118-R122 WeakPolarHBondContact O-CB 3.48Å; T119-R122 WeakPolarHBondContact O-CB 3.27Å; V120-R122 PolarHBondContact O-N 2.78Å; R122-V124 HydrophobicContact CG-CG2 4.31Å; R122-Y152 HydrophobicContact CB-CD1 3.82Å; R122-Y152 HydrophobicContact CB-CE1 3.76Å; R122-Y152 HydrophobicContact CG-CD1 3.65Å; R122-Y152 HydrophobicContact CG-CE1 4.02Å; R122-Y152 HydrophobicContact CG-CG 4.32Å; R122-Y152 WeakPolarHBondContact O-CD1 3.47Å
123	R	98.2	Very high	96.7	Very high	114 Å²	114	68.7 Å²	68.7	43%	0.43	36%	0.363	S	S	.	.			trans	-132.7	124.6	173.7	-66.1	-61.8	-170.5	-124.8	6.3	109.1	Q121 Y152 P153 P207	Q121-R123 PolarHBondContact O-N 3.45Å; R123-Y152 CarbonylContact C-O 3.59Å; R123-Y152 WeakPolarHBondContact CA-O 3.3Å; R123-P153 VanDerWaalsContact NH1-CG 3.29Å; R123-P207 VanDerWaalsContact CZ-CB 3.46Å; R123-P207 VanDerWaalsContact NE-CB 3.34Å; R123-P207 PolarHBondContact NE-O 3.27Å
124	V	98.3	Very high	95.9	Very high	41 Å²	41	72.6 Å²	72.6	25%	0.248	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-125.6	130.1	174.7	-171.7	0	0	0	0	108.6	R122 G150 F151 Y152 H206	R122-V124 HydrophobicContact CG-CG2 4.31Å; V124-G150 WeakPolarHBondContact CG1-O 3.27Å; V124-F151 WeakPolarHBondContact O-CA 3.13Å; V124-Y152 PolarHBondContact N-O 2.86Å; V124-Y152 PolarHBondContact O-N 3.15Å; V124-H206 PolarHBondContact O-CE1 3Å
125	H	98	Very high	94.6	Very high	119 Å²	119	75.1 Å²	75.1	55%	0.551	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-71.4	136.6	-175	-75.1	64.4	0	0	0	111.9	S208 V209	H125-S208 WeakPolarHBondContact CA-OG 3.49Å; H125-S208 PolarHBondContact CE1-O 3.08Å; H125-S208 PolarHBondContact NE2-O 2.89Å; H125-S208 VanDerWaalsContact NE2-O 3.12Å; H125-V209 WeakPolarHBondContact CD2-CG1 3.47Å
126	P	98.4	Very high	93.1	Very high	11 Å²	11	78.6 Å²	78.6	7%	0.071	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-69.5	138.1	172.8	25.2	-30.8	0	0	0	111.6	V128 V148 F151 V204 H206 L213	P126-V128 HydrophobicContact CB-CG2 4.42Å; P126-V148 HydrophobicContact CB-CG1 3.53Å; P126-F151 HydrophobicContact CB-CB 3.77Å; P126-F151 HydrophobicContact CB-CD1 4.12Å; P126-F151 HydrophobicContact CB-CG 4.23Å; P126-F151 HydrophobicContact CG-CB 4.41Å; P126-V204 HydrophobicContact CG-CG1 4.13Å; P126-H206 HydrophobicContact CG-CB 4.25Å; P126-L213 HydrophobicContact CG-CD1 3.71Å
127	K	98.2	Very high	91.6	Very high	146 Å²	146	79 Å²	79	64%	0.635	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.5	161.1	-175.5	178	178.9	-179.7	0	108.5	V148 S149	K127-V148 WeakPolarHBondContact O-CA 3.36Å; K127-S149 PolarHBondContact N-O 3.44Å; K127-S149 PolarHBondContact O-N 3.07Å
128	V	98.4	Very high	90.1	Very high	24 Å²	24	76.8 Å²	76.8	15%	0.145	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	132.5	-178.8	-172.8	0	0	0	0	109.4	P126 S147 V148 V204 L213 V215	P126-V128 HydrophobicContact CB-CG2 4.42Å; V128-S147 WeakPolarHBondContact CA-O 3.32Å; V128-V148 HydrophobicContact CG1-CG2 4.46Å; V128-V148 HydrophobicContact CG2-CG1 4.31Å; V128-V204 HydrophobicContact CG1-CG2 4.13Å; V128-V204 HydrophobicContact CG2-CB 4.23Å; V128-V204 HydrophobicContact CG2-CG2 3.73Å; V128-L213 HydrophobicContact CG2-CD1 4.25Å; V128-V215 HydrophobicContact CB-CG2 3.74Å; V128-V215 HydrophobicContact CG1-CB 4.04Å; V128-V215 HydrophobicContact CG1-CG2 3.57Å
129	T	97.1	Very high	88.8	Confident	61 Å²	61	78.2 Å²	78.2	37%	0.374	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	130.4	175.3	-54.3	0	0	0	0	109.4	Y131 S147	T129-Y131 HydrophobicContact CG2-CD1 4.11Å; T129-S147 PolarHBondContact N-O 2.61Å; T129-S147 PolarHBondContact O-N 2.72Å
130	V	96.8	Very high	87.8	Confident	19 Å²	19	81.4 Å²	81.4	12%	0.115	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.5	179	179.8	0	0	0	0	110.1	V145 C146 W160 C202 V215 W217	V130-V145 VanDerWaalsContact CA-O 3.31Å; V130-V145 WeakPolarHBondContact CA-O 3.2Å; V130-C146 HydrophobicContact CG2-CB 4.3Å; V130-W160 HydrophobicContact CG1-CH2 3.62Å; V130-W160 HydrophobicContact CG1-CZ3 4.23Å; V130-W160 HydrophobicContact CG2-CH2 4.39Å; V130-C202 HydrophobicContact CG2-CB 3.61Å; V130-V215 HydrophobicContact CB-CG1 4.05Å; V130-V215 HydrophobicContact CG2-CB 3.9Å; V130-V215 HydrophobicContact CG2-CG1 3.68Å; V130-W217 HydrophobicContact CB-CB 4.39Å; V130-W217 HydrophobicContact CG1-CB 3.58Å; V130-W217 HydrophobicContact CG1-CG 4.2Å
131	Y	92.5	Very high	87	Confident	95 Å²	95	85 Å²	85	37%	0.373	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	152.8	178.6	57.3	-86.9	0	0	0	111.4	T129 V145	T129-Y131 HydrophobicContact CG2-CD1 4.11Å; Y131-V145 HydrophobicContact CD2-CB 4.24Å; Y131-V145 HydrophobicContact CE1-CB 4.35Å; Y131-V145 HydrophobicContact CE1-CG1 4.23Å; Y131-V145 HydrophobicContact CE2-CB 3.88Å; Y131-V145 HydrophobicContact CE2-CG1 4.16Å; Y131-V145 HydrophobicContact CE2-CG2 4.14Å; Y131-V145 PolarHBondContact N-O 3.07Å; Y131-V145 PolarHBondContact O-N 2.85Å
132	P	92.6	Very high	86.4	Confident	38 Å²	38	80.4 Å²	80.4	25%	0.247	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	140.8	170.6	31.3	-33.6	0	0	0	110.3	K134 L144	P132-K134 PolarHBondContact O-N 2.62Å; P132-L144 HydrophobicContact CB-CD2 4.1Å
133	S	87.3	Confident	86	Confident	63 Å²	63	78.8 Å²	78.8	44%	0.441	40%	0.395	S	S	.	.	S	Bend	trans	-60.8	-34.3	176.8	175.2	0	0	0	0	112.1	L143	S133-L143 WeakPolarHBondContact CB-O 3.15Å; S133-L143 PolarHBondContact N-O 2.88Å
134	K	81.1	Confident	85.9	Confident	132 Å²	132	73.3 Å²	73.3	57%	0.574	38%	0.375	S	S	*	.	S	Bend	trans	-133.5	142.8	176	-63.8	-179.6	-177.7	175.1	0	110.4	P132 Q136 N142	P132-K134 PolarHBondContact O-N 2.62Å; K134-Q136 HydrophobicContact CB-CG 4.09Å; K134-Q136 PolarHBondContact O-N 3.2Å; K134-N142 PolarHBondContact O-ND2 2.98Å
135	T	70.1	Confident	85.8	Confident	141 Å²	141	71.8 Å²	71.8	87%	0.865	37%	0.365	S	S	*	.			trans	-74.7	77.3	169.6	-26.2	0	0	0	0	108.8
136	Q	67.6	Low	85.8	Confident	80 Å²	80	66.1 Å²	66.1	37%	0.374	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-103.5	152.6	176.1	-78.2	-170.9	4.5	0	0	111.3	K134 H141	K134-Q136 HydrophobicContact CB-CG 4.09Å; K134-Q136 PolarHBondContact O-N 3.2Å; Q136-H141 PolarHBondContact OE1-O 2.88Å
137	P	66.2	Low	85.8	Confident	78 Å²	78	66.6 Å²	66.6	51%	0.506	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-57.1	151.6	170.8	-15.5	26.5	0	0	0	111
138	L	64.9	Low	85.8	Confident	43 Å²	43	59.7 Å²	59.7	23%	0.225	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	157.2	171.6	-62.7	179.4	0	0	0	110.7	H140 P194 A219	L138-H140 VanDerWaalsContact C-N 3.28Å; L138-H140 PolarHBondContact O-N 2.97Å; L138-P194 HydrophobicContact CD2-CB 4.04Å; L138-A219 HydrophobicContact CD2-CB 3.87Å
139	Q	69.4	Low	85.8	Confident	147 Å²	147	60.2 Å²	60.2	69%	0.687	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	13.8	-177.3	-48.6	174.1	-1	0	0	115.6	V193 P194	Q139-V193 VanDerWaalsContact C-CG1 3.5Å; Q139-P194 PolarHBondContact N-O 3.04Å
140	H	76.7	Confident	85.9	Confident	103 Å²	103	58.5 Å²	58.5	48%	0.477	31%	0.313	S	S	.	.	S	Bend	trans	-110.9	159.1	165.5	-67.1	-58.5	0	0	0	111.8	L138 N142	L138-H140 VanDerWaalsContact C-N 3.28Å; L138-H140 PolarHBondContact O-N 2.97Å; H140-N142 PolarHBondContact O-N 3.42Å
141	H	80.3	Confident	86	Confident	131 Å²	131	57.6 Å²	57.6	61%	0.606	31%	0.307	S	S	*	.			trans	-60.2	119.4	174.1	-76.7	-88.4	0	0	0	110.1	Q136 E191	Q136-H141 PolarHBondContact OE1-O 2.88Å; H141-E191 IonicContact ND1-OE1 3.9Å
142	N	83.8	Confident	86.3	Confident	17 Å²	17	55.2 Å²	55.2	9%	0.091	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.8	176.6	-153.4	-18.2	0	0	0	109.9	K134 H140 T192 P194	K134-N142 PolarHBondContact O-ND2 2.98Å; H140-N142 PolarHBondContact O-N 3.42Å; N142-T192 PolarHBondContact N-O 2.79Å; N142-T192 PolarHBondContact O-N 2.77Å; N142-P194 HydrophobicContact CB-CG 4.36Å
143	L	91.1	Very high	86.5	Confident	51 Å²	51	54.5 Å²	54.5	27%	0.267	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	108.8	175.6	-167.5	73.3	0	0	0	107.5	S133 M189 L190 E191	S133-L143 WeakPolarHBondContact CB-O 3.15Å; S133-L143 PolarHBondContact N-O 2.88Å; L143-M189 HydrophobicContact CD1-CB 3.83Å; L143-M189 HydrophobicContact CD2-CB 3.99Å; L143-M189 HydrophobicContact CD2-CG 4.08Å; L143-M189 HydrophobicContact CD2-SD 3.83Å; L143-M189 HydrophobicContact CG-CB 3.85Å; L143-M189 HydrophobicContact CG-CG 4.37Å; L143-L190 WeakPolarHBondContact CA-O 3.25Å; L143-E191 HydrophobicContact CD1-CB 4.21Å
144	L	95	Very high	87	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	127.5	172.2	-67	179.7	0	0	0	108.7	P132 W160 M189 L190 T192 Y200 W217	P132-L144 HydrophobicContact CB-CD2 4.1Å; L144-W160 HydrophobicContact CB-CH2 3.76Å; L144-W160 HydrophobicContact CB-CZ2 4.06Å; L144-W160 HydrophobicContact CB-CZ3 4.45Å; L144-M189 CarbonylContact O-C 3.48Å; L144-M189 WeakPolarHBondContact O-CA 3.3Å; L144-L190 HydrophobicContact CB-CB 4.49Å; L144-L190 PolarHBondContact N-O 2.85Å; L144-L190 PolarHBondContact O-N 3.29Å; L144-T192 HydrophobicContact CD1-CG2 3.96Å; L144-T192 HydrophobicContact CG-CG2 4.12Å; L144-Y200 HydrophobicContact CD1-CD1 3.65Å; L144-Y200 HydrophobicContact CD1-CD2 3.86Å; L144-Y200 HydrophobicContact CD1-CE1 4.16Å; L144-Y200 HydrophobicContact CD1-CE2 4.37Å; L144-Y200 HydrophobicContact CD1-CG 3.47Å; L144-Y200 VanDerWaalsContact CD1-CG 3.47Å; L144-W217 HydrophobicContact CD1-CD2 4.38Å; L144-W217 HydrophobicContact CD1-CE3 3.65Å; L144-W217 HydrophobicContact CD1-CZ3 3.84Å; L144-W217 HydrophobicContact CD2-CD2 3.79Å; L144-W217 HydrophobicContact CD2-CE3 3.74Å; L144-W217 HydrophobicContact CD2-CG 4.48Å; L144-W217 HydrophobicContact CD2-CH2 3.96Å; L144-W217 HydrophobicContact CD2-CZ2 4Å; L144-W217 HydrophobicContact CD2-CZ3 3.82Å; L144-W217 HydrophobicContact CG-CE3 4.37Å; L144-W217 HydrophobicContact CG-CZ3 4.43Å
145	V	97	Very high	87.8	Confident	8 Å²	8	49.2 Å²	49.2	5%	0.048	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.1	-176.2	-173.8	0	0	0	0	108.7	V130 Y131 L187 M189	V130-V145 VanDerWaalsContact CA-O 3.31Å; V130-V145 WeakPolarHBondContact CA-O 3.2Å; Y131-V145 HydrophobicContact CD2-CB 4.24Å; Y131-V145 HydrophobicContact CE1-CB 4.35Å; Y131-V145 HydrophobicContact CE1-CG1 4.23Å; Y131-V145 HydrophobicContact CE2-CB 3.88Å; Y131-V145 HydrophobicContact CE2-CG1 4.16Å; Y131-V145 HydrophobicContact CE2-CG2 4.14Å; Y131-V145 PolarHBondContact N-O 3.07Å; Y131-V145 PolarHBondContact O-N 2.85Å; V145-L187 HydrophobicContact CG1-CB 4.47Å; V145-L187 HydrophobicContact CG1-CD2 3.52Å; V145-M189 HydrophobicContact CG1-CG 4.29Å; V145-M189 HydrophobicContact CG2-CG 4.25Å
146	C	98.2	Very high	89.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	102.9	164.3	-174	0	0	0	0	108.4	V130 W160 V188 C202	V130-C146 HydrophobicContact CG2-CB 4.3Å; C146-W160 HydrophobicContact CB-CH2 4.22Å; C146-W160 HydrophobicContact CB-CZ2 3.56Å; C146-V188 WeakPolarHBondContact CB-O 3.46Å; C146-V188 PolarHBondContact N-O 2.97Å; C146-V188 PolarHBondContact O-N 2.86Å; C146-C202 HydrophobicContact CB-CB 3.64Å; C146-C202 WeakPolarHBondContact CB-SG 3.4Å; C146-C202 WeakPolarHBondContact SG-CB 3.48Å; C146-C202 CovalentContact SG-SG 2.02Å; C146-C202 PolarHBondContact SG-SG 2.9Å
147	S	98.2	Very high	90.6	Very high	22 Å²	22	45.3 Å²	45.3	15%	0.154	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.8	175.3	-179.8	0	0	0	0	108.9	V128 T129	V128-S147 WeakPolarHBondContact CA-O 3.32Å; T129-S147 PolarHBondContact N-O 2.61Å; T129-S147 PolarHBondContact O-N 2.72Å
148	V	98.6	Very high	92.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.2	177.6	-169.8	0	0	0	0	108.1	P126 K127 V128 F151 I156 V158 Q185 T186 V204	P126-V148 HydrophobicContact CB-CG1 3.53Å; K127-V148 WeakPolarHBondContact O-CA 3.36Å; V128-V148 HydrophobicContact CG1-CG2 4.46Å; V128-V148 HydrophobicContact CG2-CG1 4.31Å; V148-F151 HydrophobicContact CB-CE1 4.32Å; V148-F151 HydrophobicContact CG1-CD1 3.88Å; V148-F151 HydrophobicContact CG1-CE1 3.88Å; V148-F151 WeakPolarHBondContact O-CE1 3.38Å; V148-I156 HydrophobicContact CG1-CD1 3.62Å; V148-V158 HydrophobicContact CG2-CG1 4.34Å; V148-V158 HydrophobicContact CG2-CG2 4.07Å; V148-Q185 CarbonylContact O-C 3.44Å; V148-Q185 VanDerWaalsContact O-CA 3.25Å; V148-Q185 WeakPolarHBondContact O-CA 3.42Å; V148-T186 HydrophobicContact CB-CG2 4.02Å; V148-T186 PolarHBondContact N-O 3.33Å; V148-T186 PolarHBondContact O-N 3.4Å; V148-V204 HydrophobicContact CG1-CG1 4.14Å; V148-V204 HydrophobicContact CG1-CG2 4.43Å; V148-V204 HydrophobicContact CG2-CG2 3.81Å
149	S	98.3	Very high	93.8	Very high	35 Å²	35	43.6 Å²	43.6	25%	0.245	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.6	-171.4	62.8	0	0	0	0	113.9	K127 F151 F184	K127-S149 PolarHBondContact N-O 3.44Å; K127-S149 PolarHBondContact O-N 3.07Å; S149-F151 VanDerWaalsContact C-N 3.34Å; S149-F151 PolarHBondContact O-N 3.3Å; S149-F184 CarbonylContact C-O 3.59Å
150	G	98.1	Very high	95.1	Very high	26 Å²	26	36.7 Å²	36.7	27%	0.268	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.4	17.5	172.6	0	0	0	0	0	114.6	V124 F184	V124-G150 WeakPolarHBondContact CG1-O 3.27Å; G150-F184 PolarHBondContact N-O 2.83Å
151	F	98.6	Very high	96.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	160.2	-176.4	61.2	-87.7	0	0	0	113.1	V124 P126 V148 S149 P153 I156 L176 T183 F184 T186 H206	V124-F151 WeakPolarHBondContact O-CA 3.13Å; P126-F151 HydrophobicContact CB-CB 3.77Å; P126-F151 HydrophobicContact CB-CD1 4.12Å; P126-F151 HydrophobicContact CB-CG 4.23Å; P126-F151 HydrophobicContact CG-CB 4.41Å; V148-F151 HydrophobicContact CB-CE1 4.32Å; V148-F151 HydrophobicContact CG1-CD1 3.88Å; V148-F151 HydrophobicContact CG1-CE1 3.88Å; V148-F151 WeakPolarHBondContact O-CE1 3.38Å; S149-F151 VanDerWaalsContact C-N 3.34Å; S149-F151 PolarHBondContact O-N 3.3Å; F151-P153 WeakPolarHBondContact CD2-O 3.36Å; F151-I156 HydrophobicContact CD1-CD1 3.97Å; F151-I156 HydrophobicContact CD2-CB 4.47Å; F151-I156 HydrophobicContact CD2-CD1 3.85Å; F151-I156 HydrophobicContact CE1-CD1 3.77Å; F151-I156 HydrophobicContact CE2-CB 3.89Å; F151-I156 HydrophobicContact CE2-CD1 3.66Å; F151-I156 HydrophobicContact CE2-CG1 4.39Å; F151-I156 HydrophobicContact CE2-CG2 3.79Å; F151-I156 HydrophobicContact CG-CD1 4.01Å; F151-I156 HydrophobicContact CZ-CB 4.31Å; F151-I156 HydrophobicContact CZ-CD1 3.63Å; F151-I156 HydrophobicContact CZ-CG2 3.85Å; F151-L176 HydrophobicContact CE2-CD1 3.91Å; F151-L176 HydrophobicContact CZ-CD1 3.83Å; F151-T183 CarbonylContact O-C 3.52Å; F151-T183 WeakPolarHBondContact O-CA 3.44Å; F151-F184 HydrophobicContact CD1-CB 4.48Å; F151-F184 WeakPolarHBondContact CD1-O 3.37Å; F151-F184 HydrophobicContact CD2-CB 3.91Å; F151-F184 HydrophobicContact CE1-CB 4.14Å; F151-F184 HydrophobicContact CE2-CB 3.52Å; F151-F184 HydrophobicContact CE2-CG 4.35Å; F151-F184 HydrophobicContact CG-CB 4.37Å; F151-F184 HydrophobicContact CZ-CB 3.64Å; F151-F184 PolarHBondContact N-O 2.57Å; F151-F184 WeakPolarHBondContact O-CD2 3.39Å; F151-F184 PolarHBondContact O-N 3.01Å; F151-T186 HydrophobicContact CE1-CG2 4.26Å; F151-T186 HydrophobicContact CZ-CG2 4.17Å; F151-H206 AromaticContact CD2-CD2 3.91Å; F151-H206 AromaticContact CD2-NE2 3.76Å
152	Y	98.6	Very high	96.9	Very high	45 Å²	45	30.3 Å²	30.3	18%	0.176	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-156.5	137.9	172	-172.8	-80.8	0	0	0	109.3	R122 R123 V124 W182 F184 H206	R122-Y152 HydrophobicContact CB-CD1 3.82Å; R122-Y152 HydrophobicContact CB-CE1 3.76Å; R122-Y152 HydrophobicContact CG-CD1 3.65Å; R122-Y152 HydrophobicContact CG-CE1 4.02Å; R122-Y152 HydrophobicContact CG-CG 4.32Å; R122-Y152 WeakPolarHBondContact O-CD1 3.47Å; R123-Y152 CarbonylContact C-O 3.59Å; R123-Y152 WeakPolarHBondContact CA-O 3.3Å; V124-Y152 PolarHBondContact N-O 2.86Å; V124-Y152 PolarHBondContact O-N 3.15Å; Y152-W182 WeakPolarHBondContact CD2-O 3.14Å; Y152-W182 HydrophobicContact CE2-CE3 4.22Å; Y152-F184 AromaticContact CD2-CD2 3.99Å; Y152-F184 HydrophobicContact CD2-CD2 3.99Å; Y152-F184 AromaticContact CD2-CE2 3.53Å; Y152-F184 HydrophobicContact CD2-CE2 3.53Å; Y152-F184 AromaticContact CE2-CE2 3.83Å; Y152-F184 HydrophobicContact CE2-CE2 3.83Å; Y152-F184 HydrophobicContact CG-CE2 4.42Å; Y152-H206 PolarHBondContact O-CE1 3.17Å; Y152-H206 PolarHBondContact O-NE2 3.16Å
153	P	98.4	Very high	97.4	Very high	22 Å²	22	34.1 Å²	34.1	14%	0.143	19%	0.187	C	C	.	.	S	Bend	cis	-76.1	-176.8	4.9	36.9	-42.6	0	0	0	112.9	R123 F151 S155 H206 P207	R123-P153 VanDerWaalsContact NH1-CG 3.29Å; F151-P153 WeakPolarHBondContact CD2-O 3.36Å; P153-S155 VanDerWaalsContact C-N 3.28Å; P153-S155 WeakPolarHBondContact CG-OG 3.35Å; P153-S155 PolarHBondContact O-N 3.33Å; P153-H206 PolarHBondContact O-NE2 2.99Å; P153-P207 HydrophobicContact CG-CG 4.39Å
154	G	97.9	Very high	97.5	Very high	16 Å²	16	34.6 Å²	34.6	17%	0.165	20%	0.204	C	C	.	.	S	Bend	trans	-71.9	-15.4	-179.1	0	0	0	0	0	115.4	I156 L176 F184	G154-I156 PolarHBondContact O-N 3.44Å; G154-L176 WeakPolarHBondContact O-CD1 3.25Å; G154-F184 VanDerWaalsContact N-CE2 3.32Å
155	S	97.6	Very high	97.6	Very high	69 Å²	69	41.5 Å²	41.5	48%	0.483	24%	0.236	S	C	.	.			trans	-70	111.4	179	59.1	0	0	0	0	110.6	P153 H206 P207	P153-S155 VanDerWaalsContact C-N 3.28Å; P153-S155 WeakPolarHBondContact CG-OG 3.35Å; P153-S155 PolarHBondContact O-N 3.33Å; S155-H206 PolarHBondContact O-CD2 2.71Å; S155-H206 VanDerWaalsContact O-CD2 3.3Å; S155-P207 VanDerWaalsContact O-CD 3.27Å; S155-P207 WeakPolarHBondContact O-CD 3.38Å
156	I	98.3	Very high	97.6	Very high	47 Å²	47	45.1 Å²	45.1	24%	0.241	25%	0.253	C	S	.	.			trans	-147.4	146.5	-176.5	-164.9	165.3	0	0	0	110.2	V148 F151 G154 V158 T186 V204 E205 H206	V148-I156 HydrophobicContact CG1-CD1 3.62Å; F151-I156 HydrophobicContact CD1-CD1 3.97Å; F151-I156 HydrophobicContact CD2-CB 4.47Å; F151-I156 HydrophobicContact CD2-CD1 3.85Å; F151-I156 HydrophobicContact CE1-CD1 3.77Å; F151-I156 HydrophobicContact CE2-CB 3.89Å; F151-I156 HydrophobicContact CE2-CD1 3.66Å; F151-I156 HydrophobicContact CE2-CG1 4.39Å; F151-I156 HydrophobicContact CE2-CG2 3.79Å; F151-I156 HydrophobicContact CG-CD1 4.01Å; F151-I156 HydrophobicContact CZ-CB 4.31Å; F151-I156 HydrophobicContact CZ-CD1 3.63Å; F151-I156 HydrophobicContact CZ-CG2 3.85Å; G154-I156 PolarHBondContact O-N 3.44Å; I156-V158 HydrophobicContact CD1-CG2 4.3Å; I156-V158 HydrophobicContact CG1-CG2 4.13Å; I156-T186 HydrophobicContact CG2-CG2 4.46Å; I156-V204 HydrophobicContact CD1-CG1 3.72Å; I156-V204 HydrophobicContact CG1-CG1 3.95Å; I156-E205 WeakPolarHBondContact CG1-O 3.28Å; I156-H206 HydrophobicContact CG1-CB 4.28Å
157	E	98.2	Very high	97.5	Very high	91 Å²	91	47.2 Å²	47.2	43%	0.425	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.6	169.6	-172.9	176	170.8	0	0	109.4	R159 V204 E205	E157-R159 HydrophobicContact CG-CG 4.3Å; E157-R159 IonicContact OE1-CZ 3.95Å; E157-R159 IonicContact OE1-NE 3.15Å; E157-R159 IonicContact OE1-NH1 4Å; E157-R159 PolarHBondContact OE1-NH1 3.37Å; E157-R159 IonicContact OE2-NH1 3.13Å; E157-V204 WeakPolarHBondContact O-CA 3.4Å; E157-E205 HydrophobicContact CB-CB 4.3Å; E157-E205 PolarHBondContact N-O 3.22Å; E157-E205 PolarHBondContact O-N 2.84Å
158	V	98.4	Very high	97.4	Very high	27 Å²	27	53.2 Å²	53.2	16%	0.164	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	121.6	-178	-177.4	0	0	0	0	108.4	V148 I156 T186 V188 Q203 V204	V148-V158 HydrophobicContact CG2-CG1 4.34Å; V148-V158 HydrophobicContact CG2-CG2 4.07Å; I156-V158 HydrophobicContact CD1-CG2 4.3Å; I156-V158 HydrophobicContact CG1-CG2 4.13Å; V158-T186 HydrophobicContact CG2-CG2 4.31Å; V158-V188 HydrophobicContact CB-CB 4.38Å; V158-V188 HydrophobicContact CB-CG2 3.76Å; V158-V188 HydrophobicContact CG1-CB 3.79Å; V158-V188 HydrophobicContact CG1-CG1 4.23Å; V158-V188 HydrophobicContact CG1-CG2 3.68Å; V158-V188 HydrophobicContact CG2-CG2 4.27Å; V158-Q203 CarbonylContact C-O 3.57Å; V158-Q203 WeakPolarHBondContact CA-O 3.43Å; V158-V204 HydrophobicContact CG1-CG2 4.24Å; V158-V204 HydrophobicContact CG2-CG1 4.41Å; V158-V204 HydrophobicContact CG2-CG2 4.22Å
159	R	98.4	Very high	97.3	Very high	59 Å²	59	58.5 Å²	58.5	22%	0.223	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.3	-175.5	-67.1	-172.4	-79.7	-134.9	7.3	111.1	E157 F161 E166 Q203 E205	E157-R159 HydrophobicContact CG-CG 4.3Å; E157-R159 IonicContact OE1-CZ 3.95Å; E157-R159 IonicContact OE1-NE 3.15Å; E157-R159 IonicContact OE1-NH1 4Å; E157-R159 PolarHBondContact OE1-NH1 3.37Å; E157-R159 IonicContact OE2-NH1 3.13Å; R159-F161 HydrophobicContact CB-CD2 4.45Å; R159-F161 HydrophobicContact CB-CE2 3.71Å; R159-F161 HydrophobicContact CB-CZ 4.41Å; R159-E166 WeakPolarHBondContact CD-OE1 3.41Å; R159-Q203 HydrophobicContact CB-CB 4.49Å; R159-Q203 PolarHBondContact N-O 2.84Å; R159-Q203 PolarHBondContact O-N 3.07Å; R159-E205 IonicContact CZ-OE1 3.92Å; R159-E205 IonicContact NH2-OE1 2.77Å; R159-E205 PolarHBondContact NH2-OE1 2.66Å; R159-E205 IonicContact NH2-OE2 2.85Å; R159-E205 PolarHBondContact NH2-OE2 2.8Å
160	W	98.4	Very high	97	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.8	172.5	-85.2	107.2	0	0	0	110.6	V130 L144 C146 E166 E167 V171 V188 L190 T201 C202	V130-W160 HydrophobicContact CG1-CH2 3.62Å; V130-W160 HydrophobicContact CG1-CZ3 4.23Å; V130-W160 HydrophobicContact CG2-CH2 4.39Å; L144-W160 HydrophobicContact CB-CH2 3.76Å; L144-W160 HydrophobicContact CB-CZ2 4.06Å; L144-W160 HydrophobicContact CB-CZ3 4.45Å; C146-W160 HydrophobicContact CB-CH2 4.22Å; C146-W160 HydrophobicContact CB-CZ2 3.56Å; W160-E166 CarbonylContact O-C 3.54Å; W160-E166 WeakPolarHBondContact O-CA 3.43Å; W160-E167 HydrophobicContact CB-CB 4.26Å; W160-E167 PolarHBondContact O-N 3.12Å; W160-V171 HydrophobicContact CB-CG2 4.36Å; W160-V188 PolarHBondContact NE1-O 3.23Å; W160-L190 HydrophobicContact CB-CD2 4.25Å; W160-L190 HydrophobicContact CD2-CB 3.94Å; W160-L190 HydrophobicContact CD2-CD2 4.13Å; W160-L190 HydrophobicContact CE3-CD2 4.17Å; W160-L190 HydrophobicContact CG-CB 3.95Å; W160-L190 HydrophobicContact CG-CD2 4.2Å; W160-L190 HydrophobicContact CZ2-CB 4.37Å; W160-T201 CarbonylContact C-O 3.6Å; W160-C202 HydrophobicContact CE3-CB 4.38Å; W160-C202 HydrophobicContact CH2-CB 4.35Å; W160-C202 HydrophobicContact CZ3-CB 4.23Å
161	F	97.9	Very high	97	Very high	39 Å²	39	59.5 Å²	59.5	17%	0.171	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.2	171.7	-63.8	-102.7	0	0	0	109.9	R159 Q165 E166 Y200 T201 Q203	R159-F161 HydrophobicContact CB-CD2 4.45Å; R159-F161 HydrophobicContact CB-CE2 3.71Å; R159-F161 HydrophobicContact CB-CZ 4.41Å; F161-Q165 CarbonylContact C-O 3.57Å; F161-Q165 WeakPolarHBondContact CA-O 3.45Å; F161-E166 HydrophobicContact CD1-CB 4.08Å; F161-E166 HydrophobicContact CE1-CB 3.81Å; F161-E166 HydrophobicContact CE1-CG 4.31Å; F161-E166 HydrophobicContact CZ-CB 4.33Å; F161-E166 HydrophobicContact CZ-CG 4.33Å; F161-Y200 CarbonylContact O-C 3.51Å; F161-Y200 VanDerWaalsContact O-CA 3.28Å; F161-Y200 WeakPolarHBondContact O-CA 3.38Å; F161-T201 PolarHBondContact N-O 2.92Å; F161-T201 PolarHBondContact O-N 3.48Å; F161-Q203 HydrophobicContact CD2-CB 4.1Å; F161-Q203 HydrophobicContact CE2-CB 3.7Å; F161-Q203 HydrophobicContact CE2-CG 4.42Å; F161-Q203 VanDerWaalsContact CE2-OE1 3.28Å
162	R	95.9	Very high	96.8	Very high	61 Å²	61	63.4 Å²	63.4	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.7	170.5	-178.8	-173.4	-173.4	163.2	6.8	108.4	G164 Q165 E167 E198 Y200	R162-G164 PolarHBondContact O-N 3.21Å; R162-G164 VanDerWaalsContact O-N 3.1Å; R162-Q165 PolarHBondContact N-O 3.13Å; R162-Q165 PolarHBondContact O-N 3.12Å; R162-E167 HydrophobicContact CB-CG 3.62Å; R162-E167 WeakPolarHBondContact CB-OE1 3.27Å; R162-E167 WeakPolarHBondContact CD-OE1 3.24Å; R162-E198 IonicContact CZ-OE1 3.68Å; R162-E198 IonicContact CZ-OE2 2.82Å; R162-E198 IonicContact NE-OE1 3.3Å; R162-E198 PolarHBondContact NE-OE1 3.38Å; R162-E198 IonicContact NE-OE2 2.81Å; R162-E198 VanDerWaalsContact NH2-CD 3.28Å; R162-E198 IonicContact NH2-OE1 2.88Å; R162-E198 PolarHBondContact NH2-OE1 2.95Å; R162-E198 IonicContact NH2-OE2 2.83Å; R162-E198 PolarHBondContact NH2-OE2 3.14Å; R162-E198 VanDerWaalsContact NH2-OE2 3.15Å; R162-Y200 HydrophobicContact CB-CD1 4.19Å; R162-Y200 HydrophobicContact CB-CE1 4.11Å; R162-Y200 HydrophobicContact CG-CD1 4.21Å; R162-Y200 HydrophobicContact CG-CE1 3.76Å; R162-Y200 PolarHBondContact NE-OH 3.34Å
163	N	94.4	Very high	96.8	Very high	97 Å²	97	64.3 Å²	64.3	52%	0.519	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	37	-176.5	-56.1	-33.6	0	0	0	112.8	V199	N163-V199 PolarHBondContact N-O 3.44Å; N163-V199 PolarHBondContact OD1-N 2.78Å; N163-V199 PolarHBondContact OD1-O 3Å
164	G	93.3	Very high	96.6	Very high	60 Å²	60	66.3 Å²	66.3	62%	0.619	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-3.4	-179.3	0	0	0	0	0	116.2	R162	R162-G164 PolarHBondContact O-N 3.21Å; R162-G164 VanDerWaalsContact O-N 3.1Å
165	Q	96.6	Very high	96.6	Very high	146 Å²	146	67.1 Å²	67.1	68%	0.682	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.9	173.9	-66.2	-171.7	-15.6	0	0	111	F161 R162 E167	F161-Q165 CarbonylContact C-O 3.57Å; F161-Q165 WeakPolarHBondContact CA-O 3.45Å; R162-Q165 PolarHBondContact N-O 3.13Å; R162-Q165 PolarHBondContact O-N 3.12Å; Q165-E167 PolarHBondContact O-N 2.99Å
166	E	97.6	Very high	96.6	Very high	84 Å²	84	67.4 Å²	67.4	39%	0.393	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.1	179.7	-168.7	-171.8	-178.7	0	0	110.9	R159 W160 F161 K168	R159-E166 WeakPolarHBondContact CD-OE1 3.41Å; W160-E166 CarbonylContact O-C 3.54Å; W160-E166 WeakPolarHBondContact O-CA 3.43Å; F161-E166 HydrophobicContact CD1-CB 4.08Å; F161-E166 HydrophobicContact CE1-CB 3.81Å; F161-E166 HydrophobicContact CE1-CG 4.31Å; F161-E166 HydrophobicContact CZ-CB 4.33Å; F161-E166 HydrophobicContact CZ-CG 4.33Å; E166-K168 HydrophobicContact CG-CG 4.49Å; E166-K168 WeakPolarHBondContact OE1-CE 3.46Å; E166-K168 IonicContact OE1-NZ 3.77Å; E166-K168 WeakPolarHBondContact OE2-CE 3.25Å; E166-K168 IonicContact OE2-NZ 3.84Å; E166-K168 PolarHBondContact OE2-NZ 2.85Å
167	E	96.8	Very high	96.5	Very high	43 Å²	43	68.1 Å²	68.1	20%	0.201	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.7	177.2	-70.5	-71.8	-176.3	0	0	109.7	W160 R162 Q165 V171 L190	W160-E167 HydrophobicContact CB-CB 4.26Å; W160-E167 PolarHBondContact O-N 3.12Å; R162-E167 HydrophobicContact CB-CG 3.62Å; R162-E167 WeakPolarHBondContact CB-OE1 3.27Å; R162-E167 WeakPolarHBondContact CD-OE1 3.24Å; Q165-E167 PolarHBondContact O-N 2.99Å; E167-V171 WeakPolarHBondContact O-CG2 3.36Å; E167-L190 HydrophobicContact CB-CD1 4.06Å; E167-L190 HydrophobicContact CB-CD2 4.47Å
168	K	95.9	Very high	96.5	Very high	149 Å²	149	70.4 Å²	70.4	65%	0.648	39%	0.391	S	S	*	.			trans	-114	-33.6	178	-62.4	-175.3	-178.9	179.4	0	112.4	E166	E166-K168 HydrophobicContact CG-CG 4.49Å; E166-K168 WeakPolarHBondContact OE1-CE 3.46Å; E166-K168 IonicContact OE1-NZ 3.77Å; E166-K168 WeakPolarHBondContact OE2-CE 3.25Å; E166-K168 IonicContact OE2-NZ 3.84Å; E166-K168 PolarHBondContact OE2-NZ 2.85Å
169	T	95.3	Very high	96.5	Very high	110 Å²	110	72 Å²	72	68%	0.675	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	134.5	176.3	31.9	0	0	0	0	110.9	V171	T169-V171 PolarHBondContact O-N 3.05Å
170	G	92.6	Very high	96.4	Very high	33 Å²	33	72.8 Å²	72.8	34%	0.34	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	9	-179.5	0	0	0	0	0	114.4	E191	G170-E191 PolarHBondContact O-N 3.19Å
171	V	97.1	Very high	96.3	Very high	50 Å²	50	77.4 Å²	77.4	30%	0.303	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	126.7	173.8	-179.3	0	0	0	0	110.3	W160 E167 T169 V188 M189 L190	W160-V171 HydrophobicContact CB-CG2 4.36Å; E167-V171 WeakPolarHBondContact O-CG2 3.36Å; T169-V171 PolarHBondContact O-N 3.05Å; V171-V188 HydrophobicContact CG1-CG1 3.61Å; V171-M189 CarbonylContact C-O 3.58Å; V171-M189 VanDerWaalsContact CA-O 3.26Å; V171-M189 WeakPolarHBondContact CA-O 3.41Å; V171-L190 HydrophobicContact CG2-CD1 3.74Å
172	V	96.2	Very high	96.3	Very high	81 Å²	81	82.3 Å²	82.3	49%	0.491	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.3	178.6	-177.1	0	0	0	0	109.3	M189	V172-M189 HydrophobicContact CB-CE 4.2Å; V172-M189 HydrophobicContact CG1-CE 3.96Å; V172-M189 PolarHBondContact N-O 2.82Å; V172-M189 PolarHBondContact O-N 2.83Å
173	S	96.7	Very high	96.4	Very high	64 Å²	64	80.4 Å²	80.4	45%	0.448	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.9	177.7	179.6	0	0	0	0	110.9	G175 T186 L187	S173-G175 PolarHBondContact O-N 2.81Å; S173-G175 PolarHBondContact OG-N 2.8Å; S173-T186 PolarHBondContact OG-OG1 3.33Å; S173-L187 WeakPolarHBondContact CA-O 3.2Å
174	T	95.6	Very high	96.6	Very high	65 Å²	65	76.8 Å²	76.8	40%	0.399	44%	0.442	S	S	.	.			trans	-70.5	-11.6	168.2	53.9	0	0	0	0	113.1	L187 M189	T174-L187 HydrophobicContact CG2-CB 3.82Å; T174-L187 HydrophobicContact CG2-CD1 3.88Å; T174-L187 HydrophobicContact CG2-CG 4.49Å; T174-L187 PolarHBondContact N-O 2.84Å; T174-L187 PolarHBondContact OG1-N 2.59Å; T174-M189 HydrophobicContact CG2-CE 4.2Å
175	G	96.3	Very high	96.9	Very high	33 Å²	33	77 Å²	77	34%	0.34	43%	0.427	S	S	.	.			trans	72.4	-175.8	-162.7	0	0	0	0	0	111.6	S173 T186	S173-G175 PolarHBondContact O-N 2.81Å; S173-G175 PolarHBondContact OG-N 2.8Å; G175-T186 PolarHBondContact O-OG1 2.88Å
176	L	97.8	Very high	96.9	Very high	74 Å²	74	70.4 Å²	70.4	39%	0.387	40%	0.396	S	S	.	.			trans	-80.6	122.7	-176.2	-171.9	69	0	0	0	110.9	F151 G154 F184	F151-L176 HydrophobicContact CE2-CD1 3.91Å; F151-L176 HydrophobicContact CZ-CD1 3.83Å; G154-L176 WeakPolarHBondContact O-CD1 3.25Å; L176-F184 HydrophobicContact CD1-CB 3.79Å; L176-F184 HydrophobicContact CD1-CD1 3.6Å; L176-F184 HydrophobicContact CD1-CE1 4.37Å; L176-F184 HydrophobicContact CD1-CG 3.93Å; L176-F184 HydrophobicContact CD2-CD1 3.69Å; L176-F184 HydrophobicContact CD2-CE1 3.6Å; L176-F184 HydrophobicContact CD2-CZ 4.49Å; L176-F184 HydrophobicContact CG-CD1 3.53Å; L176-F184 HydrophobicContact CG-CE1 3.95Å; L176-F184 HydrophobicContact CG-CG 4.36Å
177	I	98	Very high	97	Very high	62 Å²	62	68.4 Å²	68.4	32%	0.318	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.9	178.6	-58.8	168.4	0	0	0	109	F184 Q185	I177-F184 VanDerWaalsContact O-CA 3.31Å; I177-F184 WeakPolarHBondContact O-CA 3.07Å; I177-Q185 HydrophobicContact CB-CG 3.7Å; I177-Q185 WeakPolarHBondContact CB-O 3.48Å; I177-Q185 HydrophobicContact CD1-CG 4.2Å; I177-Q185 HydrophobicContact CG2-CG 3.94Å; I177-Q185 PolarHBondContact N-O 3.3Å; I177-Q185 PolarHBondContact O-N 2.65Å
178	H	97.6	Very high	97	Very high	140 Å²	140	66.7 Å²	66.7	65%	0.648	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.8	174.5	-68.2	-115.7	0	0	0	110.2	F184	H178-F184 AromaticContact CD2-CE1 3.75Å; H178-F184 AromaticContact CE1-CE1 3.24Å; H178-F184 WeakPolarHBondContact CE1-CE1 3.4Å; H178-F184 AromaticContact CE1-CZ 3.73Å; H178-F184 AromaticContact CG-CE1 3.59Å; H178-F184 AromaticContact ND1-CE1 3.24Å; H178-F184 WeakPolarHBondContact ND1-CE1 3.31Å; H178-F184 AromaticContact ND1-CZ 3.75Å; H178-F184 AromaticContact NE2-CE1 3.53Å
179	N	97.4	Very high	97.1	Very high	60 Å²	60	61.3 Å²	61.3	32%	0.321	36%	0.358	S	S	.	.			trans	-85.4	-15.6	-176.3	-65.3	-27.2	0	0	0	114.1	D181 T183 Q185	N179-D181 VanDerWaalsContact C-N 3.3Å; N179-D181 VanDerWaalsContact CB-OD1 3.22Å; N179-D181 WeakPolarHBondContact CB-OD1 3.45Å; N179-T183 WeakPolarHBondContact CB-O 3.42Å; N179-T183 PolarHBondContact N-O 3.24Å; N179-T183 VanDerWaalsContact N-O 3.16Å; N179-T183 PolarHBondContact ND2-OG1 3.27Å; N179-Q185 PolarHBondContact OD1-NE2 3.31Å
180	G	96.5	Very high	97.2	Very high	76 Å²	76	56.2 Å²	56.2	78%	0.784	33%	0.327	S	S	*	.	S	Bend	trans	83.6	-1.8	-175	0	0	0	0	0	114.8
181	D	97.4	Very high	97.3	Very high	98 Å²	98	60.1 Å²	60.1	52%	0.524	34%	0.336	S	S	.	.	S	Bend	trans	-113.8	24.1	-179.2	70.1	-9.5	0	0	0	113.1	N179 T183	N179-D181 VanDerWaalsContact C-N 3.3Å; N179-D181 VanDerWaalsContact CB-OD1 3.22Å; N179-D181 WeakPolarHBondContact CB-OD1 3.45Å; D181-T183 VanDerWaalsContact C-N 3.26Å; D181-T183 PolarHBondContact O-N 3.08Å; D181-T183 WeakPolarHBondContact OD1-CB 3.45Å; D181-T183 PolarHBondContact OD1-N 3.23Å; D181-T183 PolarHBondContact OD1-OG1 2.96Å
182	W	97.4	Very high	97	Very high	143 Å²	143	58.3 Å²	58.3	54%	0.542	33%	0.325	S	S	.	.	S	Bend	trans	63.9	27.6	-173.4	-62.4	66.7	0	0	0	114.4	T119 Y152	T119-W182 HydrophobicContact CG2-CH2 3.78Å; T119-W182 HydrophobicContact CG2-CZ3 3.89Å; Y152-W182 WeakPolarHBondContact CD2-O 3.14Å; Y152-W182 HydrophobicContact CE2-CE3 4.22Å
183	T	98.3	Very high	96.8	Very high	21 Å²	21	56.6 Å²	56.6	13%	0.129	32%	0.315	C	S	.	.			trans	-130.1	164.3	168.6	74.4	0	0	0	0	112.1	F151 N179 D181	F151-T183 CarbonylContact O-C 3.52Å; F151-T183 WeakPolarHBondContact O-CA 3.44Å; N179-T183 WeakPolarHBondContact CB-O 3.42Å; N179-T183 PolarHBondContact N-O 3.24Å; N179-T183 VanDerWaalsContact N-O 3.16Å; N179-T183 PolarHBondContact ND2-OG1 3.27Å; D181-T183 VanDerWaalsContact C-N 3.26Å; D181-T183 PolarHBondContact O-N 3.08Å; D181-T183 WeakPolarHBondContact OD1-CB 3.45Å; D181-T183 PolarHBondContact OD1-N 3.23Å; D181-T183 PolarHBondContact OD1-OG1 2.96Å
184	F	98.6	Very high	96.4	Very high	20 Å²	20	53.7 Å²	53.7	9%	0.088	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	160.5	179.7	-65.9	-87.8	0	0	0	111.6	S149 G150 F151 Y152 G154 L176 I177 H178	S149-F184 CarbonylContact C-O 3.59Å; G150-F184 PolarHBondContact N-O 2.83Å; F151-F184 HydrophobicContact CD1-CB 4.48Å; F151-F184 WeakPolarHBondContact CD1-O 3.37Å; F151-F184 HydrophobicContact CD2-CB 3.91Å; F151-F184 HydrophobicContact CE1-CB 4.14Å; F151-F184 HydrophobicContact CE2-CB 3.52Å; F151-F184 HydrophobicContact CE2-CG 4.35Å; F151-F184 HydrophobicContact CG-CB 4.37Å; F151-F184 HydrophobicContact CZ-CB 3.64Å; F151-F184 PolarHBondContact N-O 2.57Å; F151-F184 WeakPolarHBondContact O-CD2 3.39Å; F151-F184 PolarHBondContact O-N 3.01Å; Y152-F184 AromaticContact CD2-CD2 3.99Å; Y152-F184 HydrophobicContact CD2-CD2 3.99Å; Y152-F184 AromaticContact CD2-CE2 3.53Å; Y152-F184 HydrophobicContact CD2-CE2 3.53Å; Y152-F184 AromaticContact CE2-CE2 3.83Å; Y152-F184 HydrophobicContact CE2-CE2 3.83Å; Y152-F184 HydrophobicContact CG-CE2 4.42Å; G154-F184 VanDerWaalsContact N-CE2 3.32Å; L176-F184 HydrophobicContact CD1-CB 3.79Å; L176-F184 HydrophobicContact CD1-CD1 3.6Å; L176-F184 HydrophobicContact CD1-CE1 4.37Å; L176-F184 HydrophobicContact CD1-CG 3.93Å; L176-F184 HydrophobicContact CD2-CD1 3.69Å; L176-F184 HydrophobicContact CD2-CE1 3.6Å; L176-F184 HydrophobicContact CD2-CZ 4.49Å; L176-F184 HydrophobicContact CG-CD1 3.53Å; L176-F184 HydrophobicContact CG-CE1 3.95Å; L176-F184 HydrophobicContact CG-CG 4.36Å; I177-F184 VanDerWaalsContact O-CA 3.31Å; I177-F184 WeakPolarHBondContact O-CA 3.07Å; H178-F184 AromaticContact CD2-CE1 3.75Å; H178-F184 AromaticContact CE1-CE1 3.24Å; H178-F184 WeakPolarHBondContact CE1-CE1 3.4Å; H178-F184 AromaticContact CE1-CZ 3.73Å; H178-F184 AromaticContact CG-CE1 3.59Å; H178-F184 AromaticContact ND1-CE1 3.24Å; H178-F184 WeakPolarHBondContact ND1-CE1 3.31Å; H178-F184 AromaticContact ND1-CZ 3.75Å; H178-F184 AromaticContact NE2-CE1 3.53Å
185	Q	98.4	Very high	96	Very high	65 Å²	65	58.1 Å²	58.1	30%	0.304	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.8	166.4	65.7	-177.7	-52.3	0	0	111.4	V148 I177 N179	V148-Q185 CarbonylContact O-C 3.44Å; V148-Q185 VanDerWaalsContact O-CA 3.25Å; V148-Q185 WeakPolarHBondContact O-CA 3.42Å; I177-Q185 HydrophobicContact CB-CG 3.7Å; I177-Q185 WeakPolarHBondContact CB-O 3.48Å; I177-Q185 HydrophobicContact CD1-CG 4.2Å; I177-Q185 HydrophobicContact CG2-CG 3.94Å; I177-Q185 PolarHBondContact N-O 3.3Å; I177-Q185 PolarHBondContact O-N 2.65Å; N179-Q185 PolarHBondContact OD1-NE2 3.31Å
186	T	98.4	Very high	95.5	Very high	7 Å²	7	60.3 Å²	60.3	4%	0.043	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	145.3	171.9	-175.6	0	0	0	0	109.4	V148 F151 I156 V158 S173 G175	V148-T186 HydrophobicContact CB-CG2 4.02Å; V148-T186 PolarHBondContact N-O 3.33Å; V148-T186 PolarHBondContact O-N 3.4Å; F151-T186 HydrophobicContact CE1-CG2 4.26Å; F151-T186 HydrophobicContact CZ-CG2 4.17Å; I156-T186 HydrophobicContact CG2-CG2 4.46Å; V158-T186 HydrophobicContact CG2-CG2 4.31Å; S173-T186 PolarHBondContact OG-OG1 3.33Å; G175-T186 PolarHBondContact O-OG1 2.88Å
187	L	97.9	Very high	94.9	Very high	42 Å²	42	59.9 Å²	59.9	22%	0.22	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.9	171.8	-64.7	128	0	0	0	108.3	V145 S173 T174	V145-L187 HydrophobicContact CG1-CB 4.47Å; V145-L187 HydrophobicContact CG1-CD2 3.52Å; S173-L187 WeakPolarHBondContact CA-O 3.2Å; T174-L187 HydrophobicContact CG2-CB 3.82Å; T174-L187 HydrophobicContact CG2-CD1 3.88Å; T174-L187 HydrophobicContact CG2-CG 4.49Å; T174-L187 PolarHBondContact N-O 2.84Å; T174-L187 PolarHBondContact OG1-N 2.59Å
188	V	98.1	Very high	94.6	Very high	8 Å²	8	57.9 Å²	57.9	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	114.2	175.7	-174.3	0	0	0	0	108.7	C146 V158 W160 V171	C146-V188 WeakPolarHBondContact CB-O 3.46Å; C146-V188 PolarHBondContact N-O 2.97Å; C146-V188 PolarHBondContact O-N 2.86Å; V158-V188 HydrophobicContact CB-CB 4.38Å; V158-V188 HydrophobicContact CB-CG2 3.76Å; V158-V188 HydrophobicContact CG1-CB 3.79Å; V158-V188 HydrophobicContact CG1-CG1 4.23Å; V158-V188 HydrophobicContact CG1-CG2 3.68Å; V158-V188 HydrophobicContact CG2-CG2 4.27Å; W160-V188 PolarHBondContact NE1-O 3.23Å; V171-V188 HydrophobicContact CG1-CG1 3.61Å
189	M	97.1	Very high	94.5	Very high	36 Å²	36	53.3 Å²	53.3	18%	0.177	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	137.2	-168.2	-60.6	162.4	-75.7	0	0	109.6	L143 L144 V145 V171 V172 T174	L143-M189 HydrophobicContact CD1-CB 3.83Å; L143-M189 HydrophobicContact CD2-CB 3.99Å; L143-M189 HydrophobicContact CD2-CG 4.08Å; L143-M189 HydrophobicContact CD2-SD 3.83Å; L143-M189 HydrophobicContact CG-CB 3.85Å; L143-M189 HydrophobicContact CG-CG 4.37Å; L144-M189 CarbonylContact O-C 3.48Å; L144-M189 WeakPolarHBondContact O-CA 3.3Å; V145-M189 HydrophobicContact CG1-CG 4.29Å; V145-M189 HydrophobicContact CG2-CG 4.25Å; V171-M189 CarbonylContact C-O 3.58Å; V171-M189 VanDerWaalsContact CA-O 3.26Å; V171-M189 WeakPolarHBondContact CA-O 3.41Å; V172-M189 HydrophobicContact CB-CE 4.2Å; V172-M189 HydrophobicContact CG1-CE 3.96Å; V172-M189 PolarHBondContact N-O 2.82Å; V172-M189 PolarHBondContact O-N 2.83Å; T174-M189 HydrophobicContact CG2-CE 4.2Å
190	L	97.2	Very high	94.4	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.5	175.8	173.7	67.1	0	0	0	109.6	L143 L144 W160 E167 V171 T192 Y200	L143-L190 WeakPolarHBondContact CA-O 3.25Å; L144-L190 HydrophobicContact CB-CB 4.49Å; L144-L190 PolarHBondContact N-O 2.85Å; L144-L190 PolarHBondContact O-N 3.29Å; W160-L190 HydrophobicContact CB-CD2 4.25Å; W160-L190 HydrophobicContact CD2-CB 3.94Å; W160-L190 HydrophobicContact CD2-CD2 4.13Å; W160-L190 HydrophobicContact CE3-CD2 4.17Å; W160-L190 HydrophobicContact CG-CB 3.95Å; W160-L190 HydrophobicContact CG-CD2 4.2Å; W160-L190 HydrophobicContact CZ2-CB 4.37Å; E167-L190 HydrophobicContact CB-CD1 4.06Å; E167-L190 HydrophobicContact CB-CD2 4.47Å; V171-L190 HydrophobicContact CG2-CD1 3.74Å; L190-T192 HydrophobicContact CD2-CG2 4.49Å; L190-T192 HydrophobicContact CG-CG2 4.46Å; L190-Y200 HydrophobicContact CD2-CD1 3.72Å; L190-Y200 HydrophobicContact CD2-CE1 3.98Å
191	E	95.1	Very high	94.5	Very high	115 Å²	115	47.8 Å²	47.8	54%	0.537	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.3	169.6	-171.9	178.1	177	0	0	109.8	H141 L143 G170	H141-E191 IonicContact ND1-OE1 3.9Å; L143-E191 HydrophobicContact CD1-CB 4.21Å; G170-E191 PolarHBondContact O-N 3.19Å
192	T	91.8	Very high	94.5	Very high	11 Å²	11	43.1 Å²	43.1	7%	0.067	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	170.8	-178.1	-173.6	0	0	0	0	111.8	N142 L144 L190 P194 Y200	N142-T192 PolarHBondContact N-O 2.79Å; N142-T192 PolarHBondContact O-N 2.77Å; L144-T192 HydrophobicContact CD1-CG2 3.96Å; L144-T192 HydrophobicContact CG-CG2 4.12Å; L190-T192 HydrophobicContact CD2-CG2 4.49Å; L190-T192 HydrophobicContact CG-CG2 4.46Å; T192-P194 HydrophobicContact CG2-CG 4.06Å; T192-Y200 HydrophobicContact CG2-CE1 3.83Å; T192-Y200 PolarHBondContact OG1-OH 2.81Å
193	V	90.9	Very high	94.6	Very high	45 Å²	45	38 Å²	38	27%	0.273	21%	0.209	S	C	.	.			trans	-119.1	89.9	172	-177.9	0	0	0	0	107.7	Q139 R195	Q139-V193 VanDerWaalsContact C-CG1 3.5Å; V193-R195 PolarHBondContact O-N 3.43Å
194	P	88.3	Confident	94.6	Very high	3 Å²	3	37 Å²	37	2%	0.019	20%	0.203	C	C	.	.			trans	-64.8	132.7	-171.9	-19.2	30.2	0	0	0	112.4	L138 Q139 N142 T192 Y200 W217 A219	L138-P194 HydrophobicContact CD2-CB 4.04Å; Q139-P194 PolarHBondContact N-O 3.04Å; N142-P194 HydrophobicContact CB-CG 4.36Å; T192-P194 HydrophobicContact CG2-CG 4.06Å; P194-Y200 HydrophobicContact CB-CE2 4.3Å; P194-W217 HydrophobicContact CB-CH2 3.83Å; P194-W217 HydrophobicContact CB-CZ3 3.92Å; P194-W217 HydrophobicContact CG-CH2 3.96Å; P194-W217 HydrophobicContact CG-CZ3 4.15Å; P194-A219 HydrophobicContact CB-CB 3.96Å
195	R	87	Confident	94.6	Very high	158 Å²	158	39 Å²	39	60%	0.596	21%	0.213	S	C	*	.			trans	-108.8	149.7	174.1	-58.3	179.2	178.3	-177.8	0.2	110.8	V193 G197 E198 A219	V193-R195 PolarHBondContact O-N 3.43Å; R195-G197 PolarHBondContact O-N 2.97Å; R195-E198 HydrophobicContact CB-CG 4.06Å; R195-E198 PolarHBondContact N-OE2 3.4Å; R195-E198 WeakPolarHBondContact O-CB 3.45Å; R195-E198 WeakPolarHBondContact O-CG 3.41Å; R195-E198 PolarHBondContact O-N 2.98Å; R195-E198 VanDerWaalsContact O-N 3.12Å; R195-A219 WeakPolarHBondContact O-CB 3.19Å
196	S	85.9	Confident	94.6	Very high	80 Å²	80	36.4 Å²	36.4	56%	0.559	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	129.6	179.9	-175.1	0	0	0	0	111.2	A219	S196-A219 WeakPolarHBondContact CA-O 3.34Å
197	G	85.6	Confident	94.5	Very high	64 Å²	64	39 Å²	39	66%	0.66	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.2	-5.8	179.8	0	0	0	0	0	114.9	R195 A219	R195-G197 PolarHBondContact O-N 2.97Å; G197-A219 PolarHBondContact N-O 3.43Å; G197-A219 VanDerWaalsContact N-O 3.11Å
198	E	91.8	Very high	94.5	Very high	21 Å²	21	37.8 Å²	37.8	10%	0.098	21%	0.212	C	C	.	.			trans	-75.2	143.7	171.6	-64.4	-176.8	149.7	0	0	111.6	R162 R195 Y200 A219	R162-E198 IonicContact CZ-OE1 3.68Å; R162-E198 IonicContact CZ-OE2 2.82Å; R162-E198 IonicContact NE-OE1 3.3Å; R162-E198 PolarHBondContact NE-OE1 3.38Å; R162-E198 IonicContact NE-OE2 2.81Å; R162-E198 VanDerWaalsContact NH2-CD 3.28Å; R162-E198 IonicContact NH2-OE1 2.88Å; R162-E198 PolarHBondContact NH2-OE1 2.95Å; R162-E198 IonicContact NH2-OE2 2.83Å; R162-E198 PolarHBondContact NH2-OE2 3.14Å; R162-E198 VanDerWaalsContact NH2-OE2 3.15Å; R195-E198 HydrophobicContact CB-CG 4.06Å; R195-E198 PolarHBondContact N-OE2 3.4Å; R195-E198 WeakPolarHBondContact O-CB 3.45Å; R195-E198 WeakPolarHBondContact O-CG 3.41Å; R195-E198 PolarHBondContact O-N 2.98Å; R195-E198 VanDerWaalsContact O-N 3.12Å; E198-Y200 HydrophobicContact CB-CD2 4.42Å; E198-Y200 HydrophobicContact CB-CE2 3.74Å; E198-Y200 PolarHBondContact OE2-OH 2.84Å; E198-A219 HydrophobicContact CB-CB 4.48Å; E198-A219 PolarHBondContact O-N 2.93Å
199	V	94.4	Very high	94.5	Very high	44 Å²	44	38.7 Å²	38.7	27%	0.267	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.5	175.1	-177	0	0	0	0	108.6	N163 E216	N163-V199 PolarHBondContact N-O 3.44Å; N163-V199 PolarHBondContact OD1-N 2.78Å; N163-V199 PolarHBondContact OD1-O 3Å; V199-E216 HydrophobicContact CG1-CB 4.2Å; V199-E216 HydrophobicContact CG1-CG 4.31Å
200	Y	96.2	Very high	94.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	134.8	175.8	-65.4	-98.1	0	0	0	108.6	L144 F161 R162 L190 T192 P194 E198 E216 W217	L144-Y200 HydrophobicContact CD1-CD1 3.65Å; L144-Y200 HydrophobicContact CD1-CD2 3.86Å; L144-Y200 HydrophobicContact CD1-CE1 4.16Å; L144-Y200 HydrophobicContact CD1-CE2 4.37Å; L144-Y200 HydrophobicContact CD1-CG 3.47Å; L144-Y200 VanDerWaalsContact CD1-CG 3.47Å; F161-Y200 CarbonylContact O-C 3.51Å; F161-Y200 VanDerWaalsContact O-CA 3.28Å; F161-Y200 WeakPolarHBondContact O-CA 3.38Å; R162-Y200 HydrophobicContact CB-CD1 4.19Å; R162-Y200 HydrophobicContact CB-CE1 4.11Å; R162-Y200 HydrophobicContact CG-CD1 4.21Å; R162-Y200 HydrophobicContact CG-CE1 3.76Å; R162-Y200 PolarHBondContact NE-OH 3.34Å; L190-Y200 HydrophobicContact CD2-CD1 3.72Å; L190-Y200 HydrophobicContact CD2-CE1 3.98Å; T192-Y200 HydrophobicContact CG2-CE1 3.83Å; T192-Y200 PolarHBondContact OG1-OH 2.81Å; P194-Y200 HydrophobicContact CB-CE2 4.3Å; E198-Y200 HydrophobicContact CB-CD2 4.42Å; E198-Y200 HydrophobicContact CB-CE2 3.74Å; E198-Y200 PolarHBondContact OE2-OH 2.84Å; Y200-E216 CarbonylContact O-C 3.47Å; Y200-E216 WeakPolarHBondContact O-CA 3.32Å; Y200-W217 AromaticContact CD2-CE3 3.62Å; Y200-W217 HydrophobicContact CD2-CE3 3.62Å; Y200-W217 AromaticContact CD2-CZ3 3.67Å; Y200-W217 HydrophobicContact CD2-CZ3 3.67Å; Y200-W217 HydrophobicContact CE2-CE3 4.39Å; Y200-W217 AromaticContact CE2-CZ3 3.97Å; Y200-W217 HydrophobicContact CE2-CZ3 3.97Å; Y200-W217 HydrophobicContact CG-CE3 4.22Å; Y200-W217 PolarHBondContact N-O 3.45Å; Y200-W217 PolarHBondContact O-N 2.98Å
201	T	98	Very high	94.3	Very high	19 Å²	19	47.7 Å²	47.7	12%	0.117	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.2	-177	-50.1	0	0	0	0	109.4	W160 F161 T214 V215 E216	W160-T201 CarbonylContact C-O 3.6Å; F161-T201 PolarHBondContact N-O 2.92Å; F161-T201 PolarHBondContact O-N 3.48Å; T201-T214 HydrophobicContact CG2-CG2 4.13Å; T201-V215 WeakPolarHBondContact CA-O 3.48Å; T201-E216 HydrophobicContact CG2-CG 4.15Å
202	C	98.2	Very high	94.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.9	165.1	-178.6	0	0	0	0	108.6	V130 C146 W160 T214 V215	V130-C202 HydrophobicContact CG2-CB 3.61Å; C146-C202 HydrophobicContact CB-CB 3.64Å; C146-C202 WeakPolarHBondContact CB-SG 3.4Å; C146-C202 WeakPolarHBondContact SG-CB 3.48Å; C146-C202 CovalentContact SG-SG 2.02Å; C146-C202 PolarHBondContact SG-SG 2.9Å; W160-C202 HydrophobicContact CE3-CB 4.38Å; W160-C202 HydrophobicContact CH2-CB 4.35Å; W160-C202 HydrophobicContact CZ3-CB 4.23Å; C202-T214 WeakPolarHBondContact O-CA 3.06Å; C202-V215 PolarHBondContact N-O 3Å; C202-V215 PolarHBondContact O-N 2.82Å
203	Q	98.5	Very high	94.6	Very high	35 Å²	35	46.9 Å²	46.9	16%	0.164	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	132.3	175.4	-173.9	-177.1	55	0	0	109.5	V158 R159 F161 P212 L213 T214	V158-Q203 CarbonylContact C-O 3.57Å; V158-Q203 WeakPolarHBondContact CA-O 3.43Å; R159-Q203 HydrophobicContact CB-CB 4.49Å; R159-Q203 PolarHBondContact N-O 2.84Å; R159-Q203 PolarHBondContact O-N 3.07Å; F161-Q203 HydrophobicContact CD2-CB 4.1Å; F161-Q203 HydrophobicContact CE2-CB 3.7Å; F161-Q203 HydrophobicContact CE2-CG 4.42Å; F161-Q203 VanDerWaalsContact CE2-OE1 3.28Å; Q203-P212 HydrophobicContact CG-CB 3.68Å; Q203-L213 CarbonylContact C-O 3.56Å; Q203-L213 VanDerWaalsContact CA-O 3.27Å; Q203-L213 WeakPolarHBondContact CA-O 3.27Å; Q203-T214 HydrophobicContact CB-CG2 4.3Å; Q203-T214 HydrophobicContact CG-CG2 4.07Å
204	V	98.6	Very high	94.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.9	-179.5	-179.7	0	0	0	0	109.9	P126 V128 V148 I156 E157 V158 P212 L213	P126-V204 HydrophobicContact CG-CG1 4.13Å; V128-V204 HydrophobicContact CG1-CG2 4.13Å; V128-V204 HydrophobicContact CG2-CB 4.23Å; V128-V204 HydrophobicContact CG2-CG2 3.73Å; V148-V204 HydrophobicContact CG1-CG1 4.14Å; V148-V204 HydrophobicContact CG1-CG2 4.43Å; V148-V204 HydrophobicContact CG2-CG2 3.81Å; I156-V204 HydrophobicContact CD1-CG1 3.72Å; I156-V204 HydrophobicContact CG1-CG1 3.95Å; E157-V204 WeakPolarHBondContact O-CA 3.4Å; V158-V204 HydrophobicContact CG1-CG2 4.24Å; V158-V204 HydrophobicContact CG2-CG1 4.41Å; V158-V204 HydrophobicContact CG2-CG2 4.22Å; V204-P212 WeakPolarHBondContact O-CA 3.26Å; V204-L213 HydrophobicContact CB-CB 4.33Å; V204-L213 PolarHBondContact N-O 2.84Å; V204-L213 PolarHBondContact O-N 2.8Å
205	E	98.5	Very high	95.4	Very high	64 Å²	64	50.8 Å²	50.8	30%	0.299	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.9	172.1	-61.6	-171.3	174.8	0	0	109.5	I156 E157 R159 P212	I156-E205 WeakPolarHBondContact CG1-O 3.28Å; E157-E205 HydrophobicContact CB-CB 4.3Å; E157-E205 PolarHBondContact N-O 3.22Å; E157-E205 PolarHBondContact O-N 2.84Å; R159-E205 IonicContact CZ-OE1 3.92Å; R159-E205 IonicContact NH2-OE1 2.77Å; R159-E205 PolarHBondContact NH2-OE1 2.66Å; R159-E205 IonicContact NH2-OE2 2.85Å; R159-E205 PolarHBondContact NH2-OE2 2.8Å; E205-P212 HydrophobicContact CG-CB 3.95Å; E205-P212 HydrophobicContact CG-CG 3.99Å; E205-P212 WeakPolarHBondContact OE1-CG 3.42Å
206	H	98.6	Very high	95.8	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.046	31%	0.305	C	S	.	.			trans	-151.3	140.8	-175	-179.6	-104.7	0	0	0	110.1	V124 P126 F151 Y152 P153 S155 I156 S208 V209	V124-H206 PolarHBondContact O-CE1 3Å; P126-H206 HydrophobicContact CG-CB 4.25Å; F151-H206 AromaticContact CD2-CD2 3.91Å; F151-H206 AromaticContact CD2-NE2 3.76Å; Y152-H206 PolarHBondContact O-CE1 3.17Å; Y152-H206 PolarHBondContact O-NE2 3.16Å; P153-H206 PolarHBondContact O-NE2 2.99Å; S155-H206 PolarHBondContact O-CD2 2.71Å; S155-H206 VanDerWaalsContact O-CD2 3.3Å; I156-H206 HydrophobicContact CG1-CB 4.28Å; H206-S208 PolarHBondContact CE1-OG 3Å; H206-S208 VanDerWaalsContact ND1-CB 3.27Å; H206-S208 WeakPolarHBondContact ND1-CB 3.4Å; H206-S208 PolarHBondContact ND1-N 2.74Å; H206-S208 PolarHBondContact ND1-OG 3.19Å; H206-S208 PolarHBondContact O-N 2.68Å; H206-V209 HydrophobicContact CB-CG2 4.24Å; H206-V209 WeakPolarHBondContact O-CG2 3.49Å; H206-V209 PolarHBondContact O-N 2.8Å
207	P	97.9	Very high	96.2	Very high	61 Å²	61	48.2 Å²	48.2	40%	0.396	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-8.8	-177.2	-28.4	37.2	0	0	0	116.7	R123 P153 S155	R123-P207 VanDerWaalsContact CZ-CB 3.46Å; R123-P207 VanDerWaalsContact NE-CB 3.34Å; R123-P207 PolarHBondContact NE-O 3.27Å; P153-P207 HydrophobicContact CG-CG 4.39Å; S155-P207 VanDerWaalsContact O-CD 3.27Å; S155-P207 WeakPolarHBondContact O-CD 3.38Å
208	S	97.6	Very high	96.5	Very high	16 Å²	16	47.5 Å²	47.5	11%	0.112	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-16.9	174.2	76.4	0	0	0	0	113.6	H125 H206	H125-S208 WeakPolarHBondContact CA-OG 3.49Å; H125-S208 PolarHBondContact CE1-O 3.08Å; H125-S208 PolarHBondContact NE2-O 2.89Å; H125-S208 VanDerWaalsContact NE2-O 3.12Å; H206-S208 PolarHBondContact CE1-OG 3Å; H206-S208 VanDerWaalsContact ND1-CB 3.27Å; H206-S208 WeakPolarHBondContact ND1-CB 3.4Å; H206-S208 PolarHBondContact ND1-N 2.74Å; H206-S208 PolarHBondContact ND1-OG 3.19Å; H206-S208 PolarHBondContact O-N 2.68Å
209	V	96.8	Very high	96	Very high	27 Å²	27	46.5 Å²	46.5	16%	0.164	27%	0.268	C	S	.	.			trans	-112.7	144.6	-176.9	-69.1	0	0	0	0	110.5	H125 H206 L213	H125-V209 WeakPolarHBondContact CD2-CG1 3.47Å; H206-V209 HydrophobicContact CB-CG2 4.24Å; H206-V209 WeakPolarHBondContact O-CG2 3.49Å; H206-V209 PolarHBondContact O-N 2.8Å; V209-L213 HydrophobicContact CG1-CD1 4.02Å; V209-L213 HydrophobicContact CG1-CD2 4.25Å; V209-L213 HydrophobicContact CG1-CG 4.09Å; V209-L213 HydrophobicContact CG2-CG 4.41Å
210	T	95.6	Very high	95	Very high	155 Å²	155	53.5 Å²	53.5	95%	0.951	29%	0.289	S	S	*	.	S	Bend	trans	-84.3	-23.6	-179.6	48.1	0	0	0	0	113.3
211	S	95.9	Very high	93.1	Very high	74 Å²	74	55.4 Å²	55.4	52%	0.517	30%	0.303	S	S	.	.	S	Bend	trans	-132.7	153.5	174.8	64.4	0	0	0	0	110.5	L213	S211-L213 PolarHBondContact O-N 2.76Å
212	P	96.3	Very high	91.2	Very high	53 Å²	53	61.3 Å²	61.3	34%	0.344	33%	0.329	S	S	.	.			trans	-57.7	135.3	178.2	-22.5	33	0	0	0	111.9	Q203 V204 E205	Q203-P212 HydrophobicContact CG-CB 3.68Å; V204-P212 WeakPolarHBondContact O-CA 3.26Å; E205-P212 HydrophobicContact CG-CB 3.95Å; E205-P212 HydrophobicContact CG-CG 3.99Å; E205-P212 WeakPolarHBondContact OE1-CG 3.42Å
213	L	97.1	Very high	89.1	Confident	56 Å²	56	63.7 Å²	63.7	29%	0.293	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	128.2	173.7	-64.2	173.1	0	0	0	109.1	P126 V128 Q203 V204 V209 S211	P126-L213 HydrophobicContact CG-CD1 3.71Å; V128-L213 HydrophobicContact CG2-CD1 4.25Å; Q203-L213 CarbonylContact C-O 3.56Å; Q203-L213 VanDerWaalsContact CA-O 3.27Å; Q203-L213 WeakPolarHBondContact CA-O 3.27Å; V204-L213 HydrophobicContact CB-CB 4.33Å; V204-L213 PolarHBondContact N-O 2.84Å; V204-L213 PolarHBondContact O-N 2.8Å; V209-L213 HydrophobicContact CG1-CD1 4.02Å; V209-L213 HydrophobicContact CG1-CD2 4.25Å; V209-L213 HydrophobicContact CG1-CG 4.09Å; V209-L213 HydrophobicContact CG2-CG 4.41Å; S211-L213 PolarHBondContact O-N 2.76Å
214	T	97.3	Very high	87	Confident	84 Å²	84	64.8 Å²	64.8	52%	0.515	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.5	178.3	53.8	0	0	0	0	110.5	T201 C202 Q203	T201-T214 HydrophobicContact CG2-CG2 4.13Å; C202-T214 WeakPolarHBondContact O-CA 3.06Å; Q203-T214 HydrophobicContact CB-CG2 4.3Å; Q203-T214 HydrophobicContact CG-CG2 4.07Å
215	V	97.6	Very high	85	Confident	45 Å²	45	71.1 Å²	71.1	27%	0.273	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.5	172.7	179.7	0	0	0	0	108.9	V128 V130 T201 C202	V128-V215 HydrophobicContact CB-CG2 3.74Å; V128-V215 HydrophobicContact CG1-CB 4.04Å; V128-V215 HydrophobicContact CG1-CG2 3.57Å; V130-V215 HydrophobicContact CB-CG1 4.05Å; V130-V215 HydrophobicContact CG2-CB 3.9Å; V130-V215 HydrophobicContact CG2-CG1 3.68Å; T201-V215 WeakPolarHBondContact CA-O 3.48Å; C202-V215 PolarHBondContact N-O 3Å; C202-V215 PolarHBondContact O-N 2.82Å
216	E	96.3	Very high	83.2	Confident	136 Å²	136	71.9 Å²	71.9	64%	0.636	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	145.1	-177.8	-61.5	-173.5	165.5	0	0	112.1	V199 Y200 T201	V199-E216 HydrophobicContact CG1-CB 4.2Å; V199-E216 HydrophobicContact CG1-CG 4.31Å; Y200-E216 CarbonylContact O-C 3.47Å; Y200-E216 WeakPolarHBondContact O-CA 3.32Å; T201-E216 HydrophobicContact CG2-CG 4.15Å
217	W	94.2	Very high	81.5	Confident	49 Å²	49	78.3 Å²	78.3	19%	0.186	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.8	168	179.3	89.6	0	0	0	108.7	V130 L144 P194 Y200 A219	V130-W217 HydrophobicContact CB-CB 4.39Å; V130-W217 HydrophobicContact CG1-CB 3.58Å; V130-W217 HydrophobicContact CG1-CG 4.2Å; L144-W217 HydrophobicContact CD1-CD2 4.38Å; L144-W217 HydrophobicContact CD1-CE3 3.65Å; L144-W217 HydrophobicContact CD1-CZ3 3.84Å; L144-W217 HydrophobicContact CD2-CD2 3.79Å; L144-W217 HydrophobicContact CD2-CE3 3.74Å; L144-W217 HydrophobicContact CD2-CG 4.48Å; L144-W217 HydrophobicContact CD2-CH2 3.96Å; L144-W217 HydrophobicContact CD2-CZ2 4Å; L144-W217 HydrophobicContact CD2-CZ3 3.82Å; L144-W217 HydrophobicContact CG-CE3 4.37Å; L144-W217 HydrophobicContact CG-CZ3 4.43Å; P194-W217 HydrophobicContact CB-CH2 3.83Å; P194-W217 HydrophobicContact CB-CZ3 3.92Å; P194-W217 HydrophobicContact CG-CH2 3.96Å; P194-W217 HydrophobicContact CG-CZ3 4.15Å; Y200-W217 AromaticContact CD2-CE3 3.62Å; Y200-W217 HydrophobicContact CD2-CE3 3.62Å; Y200-W217 AromaticContact CD2-CZ3 3.67Å; Y200-W217 HydrophobicContact CD2-CZ3 3.67Å; Y200-W217 HydrophobicContact CE2-CE3 4.39Å; Y200-W217 AromaticContact CE2-CZ3 3.97Å; Y200-W217 HydrophobicContact CE2-CZ3 3.97Å; Y200-W217 HydrophobicContact CG-CE3 4.22Å; Y200-W217 PolarHBondContact N-O 3.45Å; Y200-W217 PolarHBondContact O-N 2.98Å; W217-A219 HydrophobicContact CH2-CB 3.93Å; W217-A219 HydrophobicContact CZ3-CB 3.81Å
218	S	90.6	Very high	79.7	Confident	48 Å²	48	82.1 Å²	82.1	34%	0.336	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.7	-179.3	54.8	0	0	0	0	110.8	R220	S218-R220 VanDerWaalsContact C-N 3.31Å; S218-R220 PolarHBondContact O-N 2.93Å; S218-R220 PolarHBondContact OG-NE 3.2Å
219	A	83.1	Confident	78.2	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.008	47%	0.472	C	S	.	.			trans	-73.9	86	173.4	0	0	0	0	0	109.3	L138 P194 R195 S196 G197 E198 W217	L138-A219 HydrophobicContact CD2-CB 3.87Å; P194-A219 HydrophobicContact CB-CB 3.96Å; R195-A219 WeakPolarHBondContact O-CB 3.19Å; S196-A219 WeakPolarHBondContact CA-O 3.34Å; G197-A219 PolarHBondContact N-O 3.43Å; G197-A219 VanDerWaalsContact N-O 3.11Å; E198-A219 HydrophobicContact CB-CB 4.48Å; E198-A219 PolarHBondContact O-N 2.93Å; W217-A219 HydrophobicContact CH2-CB 3.93Å; W217-A219 HydrophobicContact CZ3-CB 3.81Å
220	R	72.4	Confident	77.1	Confident	190 Å²	190	90.5 Å²	90.5	72%	0.717	49%	0.493	S	S	*	.			trans	-89.3	133.6	174.1	-65.1	-175.6	-176.5	-168.6	-1.8	109.9	S218 E222	S218-R220 VanDerWaalsContact C-N 3.31Å; S218-R220 PolarHBondContact O-N 2.93Å; S218-R220 PolarHBondContact OG-NE 3.2Å; R220-E222 PolarHBondContact O-N 3.49Å
221	S	56.9	Low	76.1	Confident	41 Å²	41	85.2 Å²	85.2	29%	0.287	47%	0.47	S	S	.	.			trans	-65.8	130.6	171	176.2	0	0	0	0	109.8	S223 A224	S221-S223 PolarHBondContact O-N 2.91Å; S221-S223 VanDerWaalsContact O-N 3.08Å; S221-S223 WeakPolarHBondContact OG-CB 3.4Å; S221-S223 PolarHBondContact OG-N 3.03Å; S221-A224 WeakPolarHBondContact O-CB 3.46Å; S221-A224 PolarHBondContact O-N 3.33Å
222	E	58.3	Low	75.4	Confident	142 Å²	142	86 Å²	86	66%	0.664	47%	0.471	S	S	*	.	H	α-helix	trans	-51.5	-29.9	168.3	-75.4	-170.6	154.6	0	0	111.7	R220 A224 Q225 S226	R220-E222 PolarHBondContact O-N 3.49Å; E222-A224 VanDerWaalsContact C-N 3.28Å; E222-A224 PolarHBondContact O-N 3.17Å; E222-Q225 PolarHBondContact O-N 3.43Å; E222-S226 VanDerWaalsContact O-CB 3.24Å; E222-S226 WeakPolarHBondContact O-CB 3.41Å; E222-S226 PolarHBondContact O-N 3.04Å
223	S	54.2	Low	74.5	Confident	51 Å²	51	85.1 Å²	85.1	36%	0.357	47%	0.472	S	S	.	.	H	α-helix	trans	-58.5	-38.4	175.3	-164.4	0	0	0	0	112.2	S221 K227	S221-S223 PolarHBondContact O-N 2.91Å; S221-S223 VanDerWaalsContact O-N 3.08Å; S221-S223 WeakPolarHBondContact OG-CB 3.4Å; S221-S223 PolarHBondContact OG-N 3.03Å; S223-K227 WeakPolarHBondContact O-CB 3.4Å; S223-K227 VanDerWaalsContact O-CD 3.31Å; S223-K227 WeakPolarHBondContact O-CD 3.24Å; S223-K227 WeakPolarHBondContact O-CG 3.33Å; S223-K227 PolarHBondContact O-N 3.48Å; S223-K227 VanDerWaalsContact OG-CE 3.32Å; S223-K227 WeakPolarHBondContact OG-CE 3.02Å; S223-K227 PolarHBondContact OG-NZ 2.97Å
224	A	54.1	Low	73.9	Confident	57 Å²	57	84.5 Å²	84.5	47%	0.471	48%	0.479	S	S	.	.	H	α-helix	trans	-71.1	-39	180	0	0	0	0	0	111.9	S221 E222 M228	S221-A224 WeakPolarHBondContact O-CB 3.46Å; S221-A224 PolarHBondContact O-N 3.33Å; E222-A224 VanDerWaalsContact C-N 3.28Å; E222-A224 PolarHBondContact O-N 3.17Å; A224-M228 PolarHBondContact O-N 3.13Å
225	Q	56.3	Low	73.4	Confident	133 Å²	133	87.3 Å²	87.3	62%	0.621	48%	0.484	S	S	*	.	H	α-helix	trans	-74.6	-39.2	-179.8	-156.3	172	-2.1	0	0	111.7	E222 L229	E222-Q225 PolarHBondContact O-N 3.43Å; Q225-L229 PolarHBondContact O-N 2.88Å; Q225-L229 VanDerWaalsContact O-N 3.07Å
226	S	60	Low	73	Confident	81 Å²	81	88.8 Å²	88.8	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-64.1	-44.1	172.4	167.7	0	0	0	0	112.3	E222 L229 S230	E222-S226 VanDerWaalsContact O-CB 3.24Å; E222-S226 WeakPolarHBondContact O-CB 3.41Å; E222-S226 PolarHBondContact O-N 3.04Å; S226-L229 PolarHBondContact O-N 3.2Å; S226-S230 WeakPolarHBondContact O-CB 3.47Å; S226-S230 PolarHBondContact O-N 2.68Å
227	K	63.7	Low	72.7	Confident	144 Å²	144	87.1 Å²	87.1	63%	0.626	49%	0.488	S	S	*	.	H	α-helix	trans	-66.3	-37.7	177.2	-75.8	168.9	177	162.4	0	112.4	S223 G231	S223-K227 WeakPolarHBondContact O-CB 3.4Å; S223-K227 VanDerWaalsContact O-CD 3.31Å; S223-K227 WeakPolarHBondContact O-CD 3.24Å; S223-K227 WeakPolarHBondContact O-CG 3.33Å; S223-K227 PolarHBondContact O-N 3.48Å; S223-K227 VanDerWaalsContact OG-CE 3.32Å; S223-K227 WeakPolarHBondContact OG-CE 3.02Å; S223-K227 PolarHBondContact OG-NZ 2.97Å; K227-G231 PolarHBondContact O-N 3.39Å
228	M	60.8	Low	72.5	Confident	142 Å²	142	86.3 Å²	86.3	70%	0.7	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-44.6	172.6	-82.1	-168.7	82.6	0	0	112.1	A224 S230 G231 V232	A224-M228 PolarHBondContact O-N 3.13Å; M228-S230 PolarHBondContact O-N 2.82Å; M228-G231 PolarHBondContact O-N 2.04Å; M228-V232 WeakPolarHBondContact O-CG2 3.36Å; M228-V232 PolarHBondContact O-N 3.04Å
229	L	64.8	Low	72.6	Confident	131 Å²	131	88.6 Å²	88.6	69%	0.686	50%	0.503	S	S	*	.	H	α-helix	trans	-63.5	-41.6	178.2	-109.1	89	0	0	0	112.5	Q225 S226 G231 G233	Q225-L229 PolarHBondContact O-N 2.88Å; Q225-L229 VanDerWaalsContact O-N 3.07Å; S226-L229 PolarHBondContact O-N 3.2Å; L229-G231 VanDerWaalsContact C-N 3.35Å; L229-G233 PolarHBondContact O-N 3.46Å
230	S	73.3	Confident	73.1	Confident	87 Å²	87	94 Å²	94	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-66.4	-37.2	176.5	-171.2	0	0	0	0	112.1	S226 M228 G234	S226-S230 WeakPolarHBondContact O-CB 3.47Å; S226-S230 PolarHBondContact O-N 2.68Å; M228-S230 PolarHBondContact O-N 2.82Å; S230-G234 PolarHBondContact O-N 2.89Å
231	G	74.1	Confident	74	Confident	44 Å²	44	92.2 Å²	92.2	45%	0.454	53%	0.529	S	S	.	.	H	α-helix	trans	-67	-43.4	176.8	0	0	0	0	0	112.8	K227 M228 L229 G234 F235	K227-G231 PolarHBondContact O-N 3.39Å; M228-G231 PolarHBondContact O-N 2.04Å; L229-G231 VanDerWaalsContact C-N 3.35Å; G231-G234 PolarHBondContact O-N 3.07Å; G231-F235 WeakPolarHBondContact O-CB 3.2Å; G231-F235 PolarHBondContact O-N 2.92Å
232	V	81.3	Confident	75.6	Confident	90 Å²	90	95.5 Å²	95.5	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-64.2	-43.1	175.4	173.5	0	0	0	0	110.8	M228 G234 F235 V236	M228-V232 WeakPolarHBondContact O-CG2 3.36Å; M228-V232 PolarHBondContact O-N 3.04Å; V232-G234 PolarHBondContact O-N 3.46Å; V232-F235 PolarHBondContact O-N 3.11Å; V232-V236 HydrophobicContact CG1-CG2 4.48Å; V232-V236 WeakPolarHBondContact O-CG2 3.33Å; V232-V236 PolarHBondContact O-N 3.35Å
233	G	78	Confident	77.2	Confident	35 Å²	35	90.8 Å²	90.8	36%	0.361	53%	0.533	S	S	.	.	H	α-helix	trans	-59.4	-44.4	175.5	0	0	0	0	0	113	L229 L237	L229-G233 PolarHBondContact O-N 3.46Å; G233-L237 WeakPolarHBondContact O-CG 3.47Å; G233-L237 PolarHBondContact O-N 3.42Å; G233-L237 VanDerWaalsContact O-N 3.14Å
234	G	84.3	Confident	79	Confident	43 Å²	43	90.9 Å²	90.9	44%	0.443	54%	0.536	S	S	.	.	H	α-helix	trans	-65.2	-39	176.6	0	0	0	0	0	113.4	S230 G231 V232 L237 G238	S230-G234 PolarHBondContact O-N 2.89Å; G231-G234 PolarHBondContact O-N 3.07Å; V232-G234 PolarHBondContact O-N 3.46Å; G234-L237 PolarHBondContact O-N 2.92Å; G234-G238 PolarHBondContact O-N 3.39Å
235	F	86.6	Confident	80.6	Confident	143 Å²	143	90 Å²	90	63%	0.627	53%	0.533	S	S	*	.	H	α-helix	trans	-67.1	-42.2	178.9	-171.3	-102.5	0	0	0	112.4	G231 V232 G238 L239	G231-F235 WeakPolarHBondContact O-CB 3.2Å; G231-F235 PolarHBondContact O-N 2.92Å; V232-F235 PolarHBondContact O-N 3.11Å; F235-G238 PolarHBondContact O-N 3.03Å; F235-L239 HydrophobicContact CD1-CD1 3.86Å; F235-L239 HydrophobicContact CD1-CG 4.38Å; F235-L239 HydrophobicContact CE1-CD1 3.44Å; F235-L239 VanDerWaalsContact CE1-CD1 3.44Å; F235-L239 HydrophobicContact CE1-CG 4.08Å; F235-L239 HydrophobicContact CZ-CD1 4.07Å; F235-L239 HydrophobicContact CZ-CG 4.34Å; F235-L239 PolarHBondContact O-N 3.4Å
236	V	89.4	Confident	82.2	Confident	77 Å²	77	88.2 Å²	88.2	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-64	-44	176.6	173.5	0	0	0	0	111	V232 G238 L239 L240	V232-V236 HydrophobicContact CG1-CG2 4.48Å; V232-V236 WeakPolarHBondContact O-CG2 3.33Å; V232-V236 PolarHBondContact O-N 3.35Å; V236-G238 VanDerWaalsContact C-N 3.34Å; V236-G238 PolarHBondContact O-N 3.15Å; V236-L239 PolarHBondContact O-N 3.2Å; V236-L240 HydrophobicContact CG1-CD1 4.36Å; V236-L240 WeakPolarHBondContact O-CG 3.19Å; V236-L240 PolarHBondContact O-N 3.44Å; V236-L240 VanDerWaalsContact O-N 3.1Å
237	L	90.5	Very high	83.4	Confident	100 Å²	100	90.7 Å²	90.7	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-60.5	-43.9	174.2	-77.3	164.2	0	0	0	111.5	G233 G234 L239 L240 F241	G233-L237 WeakPolarHBondContact O-CG 3.47Å; G233-L237 PolarHBondContact O-N 3.42Å; G233-L237 VanDerWaalsContact O-N 3.14Å; G234-L237 PolarHBondContact O-N 2.92Å; L237-L239 PolarHBondContact O-N 2.67Å; L237-L240 PolarHBondContact O-N 2.9Å; L237-F241 WeakPolarHBondContact O-CD2 3.25Å; L237-F241 PolarHBondContact O-N 3.38Å; L237-F241 VanDerWaalsContact O-N 3.11Å
238	G	89.5	Confident	84.5	Confident	33 Å²	33	89.2 Å²	89.2	34%	0.34	53%	0.526	S	S	.	.	H	α-helix	trans	-59.5	-44	176.7	0	0	0	0	0	113.5	G234 F235 V236 L240 F241 L242	G234-G238 PolarHBondContact O-N 3.39Å; F235-G238 PolarHBondContact O-N 3.03Å; V236-G238 VanDerWaalsContact C-N 3.34Å; V236-G238 PolarHBondContact O-N 3.15Å; G238-L240 PolarHBondContact O-N 3.46Å; G238-F241 PolarHBondContact O-N 3.15Å; G238-L242 WeakPolarHBondContact O-CB 3.43Å; G238-L242 PolarHBondContact O-N 3.07Å
239	L	93.5	Very high	85.7	Confident	95 Å²	95	89 Å²	89	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-37	176.7	-75.2	177.1	0	0	0	112.7	F235 V236 L237 L242 G243	F235-L239 HydrophobicContact CD1-CD1 3.86Å; F235-L239 HydrophobicContact CD1-CG 4.38Å; F235-L239 HydrophobicContact CE1-CD1 3.44Å; F235-L239 VanDerWaalsContact CE1-CD1 3.44Å; F235-L239 HydrophobicContact CE1-CG 4.08Å; F235-L239 HydrophobicContact CZ-CD1 4.07Å; F235-L239 HydrophobicContact CZ-CG 4.34Å; F235-L239 PolarHBondContact O-N 3.4Å; V236-L239 PolarHBondContact O-N 3.2Å; L237-L239 PolarHBondContact O-N 2.67Å; L239-L242 PolarHBondContact O-N 3.19Å; L239-G243 PolarHBondContact O-N 3.36Å
240	L	92.8	Very high	86.4	Confident	114 Å²	114	88.1 Å²	88.1	60%	0.597	51%	0.509	S	S	*	.	H	α-helix	trans	-63.5	-44.9	175.5	-73.8	169.4	0	0	0	111.6	V236 L237 G238 G243 A244	V236-L240 HydrophobicContact CG1-CD1 4.36Å; V236-L240 WeakPolarHBondContact O-CG 3.19Å; V236-L240 PolarHBondContact O-N 3.44Å; V236-L240 VanDerWaalsContact O-N 3.1Å; L237-L240 PolarHBondContact O-N 2.9Å; G238-L240 PolarHBondContact O-N 3.46Å; L240-G243 PolarHBondContact O-N 2.65Å; L240-A244 WeakPolarHBondContact O-CB 3.26Å; L240-A244 PolarHBondContact O-N 3.48Å
241	F	91.3	Very high	86.7	Confident	154 Å²	154	92.6 Å²	92.6	68%	0.675	51%	0.513	S	S	*	.	H	α-helix	trans	-66	-39.9	176.4	-77.3	-67	0	0	0	112.5	L237 G238 G245	L237-F241 WeakPolarHBondContact O-CD2 3.25Å; L237-F241 PolarHBondContact O-N 3.38Å; L237-F241 VanDerWaalsContact O-N 3.11Å; G238-F241 PolarHBondContact O-N 3.15Å; F241-G245 PolarHBondContact O-N 3.43Å
242	L	91.9	Very high	86.5	Confident	110 Å²	110	96.3 Å²	96.3	58%	0.576	52%	0.522	S	S	*	.	H	α-helix	trans	-62.2	-45.5	174.3	-97.5	155.8	0	0	0	112.1	G238 L239 G245 L246	G238-L242 WeakPolarHBondContact O-CB 3.43Å; G238-L242 PolarHBondContact O-N 3.07Å; L239-L242 PolarHBondContact O-N 3.19Å; L242-G245 PolarHBondContact O-N 2.97Å; L242-L246 WeakPolarHBondContact O-CB 3.5Å; L242-L246 PolarHBondContact O-N 3.08Å
243	G	90.9	Very high	85.8	Confident	43 Å²	43	97 Å²	97	44%	0.443	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-45.7	177.2	0	0	0	0	0	112.5	L239 L240 L246 F247	L239-G243 PolarHBondContact O-N 3.36Å; L240-G243 PolarHBondContact O-N 2.65Å; G243-L246 PolarHBondContact O-N 3.5Å; G243-F247 WeakPolarHBondContact O-CB 3.38Å; G243-F247 PolarHBondContact O-N 2.94Å
244	A	91.3	Very high	84.8	Confident	52 Å²	52	104.2 Å²	104.2	43%	0.43	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-42.6	175.7	0	0	0	0	0	112	L240 F247 I248	L240-A244 WeakPolarHBondContact O-CB 3.26Å; L240-A244 PolarHBondContact O-N 3.48Å; A244-F247 PolarHBondContact O-N 3.34Å; A244-I248 WeakPolarHBondContact O-CG1 3.26Å; A244-I248 PolarHBondContact O-N 3.05Å
245	G	88.8	Confident	83.4	Confident	40 Å²	40	105 Å²	105	41%	0.412	55%	0.55	S	S	.	.	H	α-helix	trans	-61.5	-46.7	176.1	0	0	0	0	0	112.7	F241 L242 F247 I248 Y249	F241-G245 PolarHBondContact O-N 3.43Å; L242-G245 PolarHBondContact O-N 2.97Å; G245-F247 VanDerWaalsContact C-N 3.34Å; G245-F247 PolarHBondContact O-N 3.44Å; G245-I248 PolarHBondContact O-N 3.31Å; G245-Y249 WeakPolarHBondContact O-CB 3.35Å; G245-Y249 PolarHBondContact O-N 3.45Å
246	L	89.3	Confident	81.6	Confident	94 Å²	94	106.6 Å²	106.6	49%	0.492	56%	0.558	S	S	.	*	H	α-helix	trans	-60.5	-43.6	174.8	-112.9	82.9	0	0	0	111.5	L242 G243 I248 Y249 F250	L242-L246 WeakPolarHBondContact O-CB 3.5Å; L242-L246 PolarHBondContact O-N 3.08Å; G243-L246 PolarHBondContact O-N 3.5Å; L246-I248 PolarHBondContact O-N 3.01Å; L246-Y249 PolarHBondContact O-N 3.39Å; L246-F250 HydrophobicContact CB-CD2 4.45Å; L246-F250 HydrophobicContact CD2-CE2 3.81Å; L246-F250 HydrophobicContact CG-CD2 4.42Å; L246-F250 HydrophobicContact CG-CE2 4.01Å; L246-F250 WeakPolarHBondContact O-CD2 3.47Å; L246-F250 PolarHBondContact O-N 3.31Å
247	F	86.3	Confident	79.7	Confident	134 Å²	134	108.4 Å²	108.4	59%	0.588	57%	0.574	S	S	*	*	H	α-helix	trans	-62	-43.7	179.8	-178.1	-98.9	0	0	0	112.2	G243 A244 G245 R251	G243-F247 WeakPolarHBondContact O-CB 3.38Å; G243-F247 PolarHBondContact O-N 2.94Å; A244-F247 PolarHBondContact O-N 3.34Å; G245-F247 VanDerWaalsContact C-N 3.34Å; G245-F247 PolarHBondContact O-N 3.44Å; F247-R251 HydrophobicContact CE1-CG 4.43Å; F247-R251 WeakPolarHBondContact O-CB 3.34Å; F247-R251 PolarHBondContact O-N 3.17Å
248	I	85.6	Confident	77.5	Confident	113 Å²	113	106.7 Å²	106.7	58%	0.579	58%	0.581	S	S	*	*	H	α-helix	trans	-64.5	-44.8	175.3	-66.9	169.8	0	0	0	110.4	A244 G245 L246 F250 R251 N252	A244-I248 WeakPolarHBondContact O-CG1 3.26Å; A244-I248 PolarHBondContact O-N 3.05Å; G245-I248 PolarHBondContact O-N 3.31Å; L246-I248 PolarHBondContact O-N 3.01Å; I248-F250 PolarHBondContact O-N 2.63Å; I248-R251 PolarHBondContact O-N 3.28Å; I248-N252 PolarHBondContact O-N 3.4Å
249	Y	86.7	Confident	75.4	Confident	136 Å²	136	113.5 Å²	113.5	53%	0.533	61%	0.609	S	S	.	*	H	α-helix	trans	-58.1	-48.3	178.3	177.9	-97.8	0	0	0	112.4	G245 L246 R251 N252 Q253	G245-Y249 WeakPolarHBondContact O-CB 3.35Å; G245-Y249 PolarHBondContact O-N 3.45Å; L246-Y249 PolarHBondContact O-N 3.39Å; Y249-R251 PolarHBondContact O-N 3.13Å; Y249-N252 PolarHBondContact O-N 2.97Å; Y249-N252 VanDerWaalsContact O-N 3.17Å; Y249-Q253 HydrophobicContact CE1-CG 4.37Å; Y249-Q253 PolarHBondContact O-N 2.97Å; Y249-Q253 PolarHBondContact OH-NE2 3.3Å
250	F	79.8	Confident	72.9	Confident	113 Å²	113	117.5 Å²	117.5	50%	0.496	63%	0.625	S	S	.	*	H	α-helix	trans	-68.7	-32.8	178.3	-78.4	-63.1	0	0	0	113.3	L246 I248 N252 K254	L246-F250 HydrophobicContact CB-CD2 4.45Å; L246-F250 HydrophobicContact CD2-CE2 3.81Å; L246-F250 HydrophobicContact CG-CD2 4.42Å; L246-F250 HydrophobicContact CG-CE2 4.01Å; L246-F250 WeakPolarHBondContact O-CD2 3.47Å; L246-F250 PolarHBondContact O-N 3.31Å; I248-F250 PolarHBondContact O-N 2.63Å; F250-N252 VanDerWaalsContact C-N 3.31Å; F250-K254 PolarHBondContact O-N 3.21Å
251	R	78.4	Confident	70.6	Confident	181 Å²	181	117.7 Å²	117.7	68%	0.683	63%	0.633	S	S	*	*	H	α-helix	trans	-63.3	-37.9	170.2	-95.9	-175.1	67	154.8	-1.5	111.9	F247 I248 Y249 K254	F247-R251 HydrophobicContact CE1-CG 4.43Å; F247-R251 WeakPolarHBondContact O-CB 3.34Å; F247-R251 PolarHBondContact O-N 3.17Å; I248-R251 PolarHBondContact O-N 3.28Å; Y249-R251 PolarHBondContact O-N 3.13Å; R251-K254 PolarHBondContact O-N 3.41Å
252	N	70.5	Confident	68.4	Low	123 Å²	123	116.9 Å²	116.9	66%	0.658	64%	0.641	S	S	*	*	H	α-helix	trans	-73	-34.6	-179.4	-128.3	13.6	0	0	0	112.3	I248 Y249 F250 G255	I248-N252 PolarHBondContact O-N 3.4Å; Y249-N252 PolarHBondContact O-N 2.97Å; Y249-N252 VanDerWaalsContact O-N 3.17Å; F250-N252 VanDerWaalsContact C-N 3.31Å; N252-G255 PolarHBondContact O-N 3.22Å
253	Q	66.3	Low	65.9	Low	103 Å²	103	115.1 Å²	115.1	48%	0.481	65%	0.649	S	S	.	*	H	α-helix	trans	-66.1	-34.5	172.6	-81.6	-167.7	-22.3	0	0	113.1	Y249 G255 H256	Y249-Q253 HydrophobicContact CE1-CG 4.37Å; Y249-Q253 PolarHBondContact O-N 2.97Å; Y249-Q253 PolarHBondContact OH-NE2 3.3Å; Q253-G255 PolarHBondContact O-N 3.02Å; Q253-H256 PolarHBondContact O-N 3.44Å
254	K	57.7	Low	63.6	Low	187 Å²	187	122.7 Å²	122.7	81%	0.813	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-11.5	174.6	-80.7	-176.8	177.1	-179.9	0	114.1	F250 R251	F250-K254 PolarHBondContact O-N 3.21Å; R251-K254 PolarHBondContact O-N 3.41Å
255	G	53.8	Low	61.1	Low	61 Å²	61	128.2 Å²	128.2	63%	0.629	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-5.2	177.3	0	0	0	0	0	115.6	N252 Q253	N252-G255 PolarHBondContact O-N 3.22Å; Q253-G255 PolarHBondContact O-N 3.02Å
256	H	49	Very low	58.9	Low	175 Å²	175	135.4 Å²	135.4	81%	0.81	74%	0.736	S	S	*	*	S	Bend	trans	-106.5	15.6	-177	-95.8	65.8	0	0	0	114.6	Q253	Q253-H256 PolarHBondContact O-N 3.44Å
257	S	49.2	Very low	57.4	Low	115 Å²	115	137.5 Å²	137.5	80%	0.804	75%	0.748	S	S	*	*			trans	-115.7	73.2	173.8	-52.9	0	0	0	0	110.3
258	G	45.1	Very low	55.9	Low	65 Å²	65	137.6 Å²	137.6	67%	0.67	76%	0.756	S	S	*	*			trans	-139.1	103.2	178.1	0	0	0	0	0	112.9
259	L	45.5	Very low	54.2	Low	176 Å²	176	139 Å²	139	92%	0.921	77%	0.766	S	S	*	*			trans	47.4	118.6	152.5	-76.3	106.9	0	0	0	121.2
260	Q	40.3	Very low	52.3	Low	179 Å²	179	139.2 Å²	139.2	84%	0.836	78%	0.78	S	S	*	*			trans	-97.7	125.9	156.5	-164.1	-176.8	7.3	0	0	109.2
261	P	45.9	Very low	50.6	Low	117 Å²	117	140.8 Å²	140.8	76%	0.76	80%	0.798	S	S	*	*			trans	-89.4	121.1	168.7	30.9	-25.8	0	0	0	110.1	G263	P261-G263 PolarHBondContact O-N 3.33Å
262	T	43.5	Very low	48.8	Very low	137 Å²	137	138.1 Å²	138.1	84%	0.84	81%	0.805	S	S	*	*			trans	-78.4	105.3	165.9	37.9	0	0	0	0	109.5
263	G	39.2	Very low	47.2	Very low	73 Å²	73	139.2 Å²	139.2	75%	0.753	82%	0.816	S	S	*	*			trans	-82.2	139.3	164.8	0	0	0	0	0	111.5	P261	P261-G263 PolarHBondContact O-N 3.33Å
264	F	43.5	Very low	45.8	Very low	202 Å²	202	142 Å²	142	89%	0.886	84%	0.841	S	S	*	*			trans	-53.8	141.3	163.2	-91.6	-102.9	0	0	0	112.2
265	L	39.5	Very low	44.8	Very low	168 Å²	168	138.3 Å²	138.3	88%	0.88	84%	0.844	S	S	*	*				171.7	137.4	114.2	-91.3	166.4	0	0	0	112.6
266	S	42.5	Very low	43.9	Very low	191 Å²	191	145.3 Å²	145.3	100%	1.336	86%	0.863	S	S	*	*			trans	82.7	0	158.6	-148.5	0	0	0	0	120.7

Retrieved 266 of 266 residues in 868.9 ms (Link to these results)

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