A0A024RDT6_HUMAN Loading...

SPRY domain-containing protein 7

AlphaFold DB (Q5W111), UniProt , Accession A0A024RDT6, Species HUMAN (Homo sapiens, Human), Gene C13orf1, Length 196 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	36.8	Very low	44	Very low	242 Å²	242	145.1 Å²	145.1	100%	1.192	84%	0.835	S	S	*	*				0	107.1	0	-70.2	-147	-105	0	0	107.8
2	A	38.8	Very low	44	Very low	103 Å²	103	140.7 Å²	140.7	85%	0.851	82%	0.818	S	S	*	*			trans	-119.2	95.5	177.6	0	0	0	0	0	106.7
3	T	41.6	Very low	43.9	Very low	124 Å²	124	147.6 Å²	147.6	76%	0.761	82%	0.822	S	S	*	*			trans	-105.3	102.9	174.3	51.3	0	0	0	0	108.4	V5	T3-V5 PolarHBondContact O-N 3.48Å
4	S	44.3	Very low	43.8	Very low	106 Å²	106	148.4 Å²	148.4	74%	0.741	82%	0.824	S	S	*	*			trans	-50.4	123.6	154.5	50.2	0	0	0	0	110.7
5	V	52.8	Low	43.4	Very low	115 Å²	115	143 Å²	143	70%	0.697	82%	0.815	S	S	*	*			trans	-141.6	98.4	155.6	-170.8	0	0	0	0	107.7	T3 C7	T3-V5 PolarHBondContact O-N 3.48Å; V5-C7 HydrophobicContact CG1-CB 4.05Å; V5-C7 PolarHBondContact O-N 3.2Å
6	L	48.4	Very low	43.4	Very low	162 Å²	162	138.8 Å²	138.8	85%	0.848	81%	0.812	S	S	*	*			trans	-59.3	110.1	160.4	-69.1	92	0	0	0	107.8
7	C	45.4	Very low	43.7	Very low	104 Å²	104	138.1 Å²	138.1	70%	0.703	81%	0.811	S	S	*	*			trans	-144.6	6.5	176.1	-126.4	0	0	0	0	117.9	V5	V5-C7 HydrophobicContact CG1-CB 4.05Å; V5-C7 PolarHBondContact O-N 3.2Å
8	C	46.4	Very low	44	Very low	111 Å²	111	134.5 Å²	134.5	75%	0.75	81%	0.807	S	S	*	*			trans	-140.1	25.4	-178.4	-58.6	0	0	0	0	116.4	R10	C8-R10 PolarHBondContact O-N 2.99Å
9	L	45.1	Very low	44.5	Very low	183 Å²	183	136.3 Å²	136.3	96%	0.958	81%	0.806	S	S	*	*			trans	-74.3	26.1	162.2	-89.9	157.5	0	0	0	113
10	R	44	Very low	45.2	Very low	218 Å²	218	136.6 Å²	136.6	82%	0.823	80%	0.802	S	S	*	*			trans	-122.9	52.2	172.7	-121.4	-176.1	-174.2	-158.5	2.3	109.5	C8 C12	C8-R10 PolarHBondContact O-N 2.99Å; R10-C12 PolarHBondContact O-N 2.81Å
11	C	40.7	Very low	45.5	Very low	128 Å²	128	135.5 Å²	135.5	87%	0.865	80%	0.799	S	S	*	*			trans	-66.7	79.1	151.6	-77.2	0	0	0	0	107.2	R13	C11-R13 PolarHBondContact O-N 3.29Å
12	C	43.3	Very low	46.5	Very low	92 Å²	92	131.2 Å²	131.2	62%	0.622	78%	0.78	S	S	*	*			trans	-48.6	124.3	167.8	-69.9	0	0	0	0	109.6	R10	R10-C12 PolarHBondContact O-N 2.81Å
13	R	42.8	Very low	47.7	Very low	231 Å²	231	135.1 Å²	135.1	87%	0.872	78%	0.778	S	S	*	*				75.1	83	116.8	-157.4	168.3	104.9	165.8	7.9	114.6	C11	C11-R13 PolarHBondContact O-N 3.29Å
14	D	42.8	Very low	49	Very low	159 Å²	159	138 Å²	138	85%	0.85	78%	0.783	S	S	*	*				54.6	127.1	110.5	-145.3	3.3	0	0	0	117.3	G16	D14-G16 PolarHBondContact O-N 2.91Å
15	G	38.5	Very low	50.3	Low	67 Å²	67	136.1 Å²	136.1	69%	0.691	76%	0.763	S	S	*	*			trans	-50.7	113.5	-165.9	0	0	0	0	0	113.3	T17	G15-T17 PolarHBondContact O-N 3.03Å
16	G	42.3	Very low	51.8	Low	75 Å²	75	134.7 Å²	134.7	77%	0.773	76%	0.756	S	S	*	*			trans	-63.3	105.5	160.2	0	0	0	0	0	108.3	D14 G18	D14-G16 PolarHBondContact O-N 2.91Å; G16-G18 VanDerWaalsContact C-N 3.34Å; G16-G18 PolarHBondContact O-N 3.17Å
17	T	49.1	Very low	53.8	Low	128 Å²	128	130.6 Å²	130.6	79%	0.785	75%	0.745	S	S	*	*			trans	-52.6	104	157.5	49.9	0	0	0	0	106.8	G15 H19	G15-T17 PolarHBondContact O-N 3.03Å; T17-H19 PolarHBondContact O-N 3.05Å
18	G	49.4	Very low	56.2	Low	73 Å²	73	126.3 Å²	126.3	75%	0.753	72%	0.716	S	S	*	*			trans	-66.4	82	177.1	0	0	0	0	0	109.6	G16 I20	G16-G18 VanDerWaalsContact C-N 3.34Å; G16-G18 PolarHBondContact O-N 3.17Å; G18-I20 VanDerWaalsContact C-N 3.35Å; G18-I20 PolarHBondContact O-N 2.78Å
19	H	53	Low	58.6	Low	169 Å²	169	125.2 Å²	125.2	78%	0.782	70%	0.7	S	S	*	*			trans	-67.9	101.8	161.6	-119.7	-78.4	0	0	0	105.7	T17 P21	T17-H19 PolarHBondContact O-N 3.05Å; H19-P21 WeakPolarHBondContact O-CD 3.19Å; H19-P21 VanDerWaalsContact O-N 3.15Å
20	I	57.9	Low	61.1	Low	142 Å²	142	116.7 Å²	116.7	73%	0.728	66%	0.655	S	S	*	*			trans	-58.1	116.2	162.4	-60.1	170.1	0	0	0	104.5	G18 L22	G18-I20 VanDerWaalsContact C-N 3.35Å; G18-I20 PolarHBondContact O-N 2.78Å; I20-L22 PolarHBondContact O-N 2.91Å
21	P	51.3	Low	63.7	Low	113 Å²	113	107.9 Å²	107.9	73%	0.734	63%	0.625	S	S	*	*			trans	-62.3	109.3	173	-13.8	28.2	0	0	0	105.7	H19 K23	H19-P21 WeakPolarHBondContact O-CD 3.19Å; H19-P21 VanDerWaalsContact O-N 3.15Å; P21-K23 PolarHBondContact O-N 3.45Å
22	L	58.4	Low	66.4	Low	152 Å²	152	105.8 Å²	105.8	80%	0.796	61%	0.608	S	S	*	*			trans	-54.4	111.5	165	-75.1	167.8	0	0	0	104.6	I20 E24	I20-L22 PolarHBondContact O-N 2.91Å; L22-E24 PolarHBondContact O-N 2.88Å
23	K	64.6	Low	68.9	Low	186 Å²	186	108.8 Å²	108.8	81%	0.809	61%	0.613	S	S	*	*			trans	-51	111.2	180	179.9	-179.4	178.8	-176.8	0	106.5	P21 M25	P21-K23 PolarHBondContact O-N 3.45Å; K23-M25 PolarHBondContact O-N 2.91Å
24	E	68	Low	71.6	Confident	183 Å²	183	100.8 Å²	100.8	86%	0.855	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-55.6	117.4	-177.9	-168.5	171.5	-173.8	0	0	107.1	L22	L22-E24 PolarHBondContact O-N 2.88Å
25	M	73.1	Confident	74.2	Confident	68 Å²	68	96.1 Å²	96.1	34%	0.335	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-67.8	137.8	-175.8	-63.7	-177.8	71.1	0	0	107.8	K23 A27 F191 Q193	K23-M25 PolarHBondContact O-N 2.91Å; M25-A27 PolarHBondContact O-N 3.16Å; M25-F191 VanDerWaalsContact CE-C 3.5Å; M25-F191 HydrophobicContact CE-CB 3.48Å; M25-F191 VanDerWaalsContact CE-CB 3.48Å; M25-F191 WeakPolarHBondContact CE-O 3.49Å; M25-Q193 HydrophobicContact CE-CG 3.58Å; M25-Q193 HydrophobicContact SD-CG 3.54Å; M25-Q193 VanDerWaalsContact SD-CG 3.54Å; M25-Q193 PolarHBondContact SD-NE2 3.35Å
26	P	83.6	Confident	77.1	Confident	85 Å²	85	92.9 Å²	92.9	55%	0.552	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-58.5	144.7	178.8	23.8	-31.1	0	0	0	110	F191	P26-F191 HydrophobicContact CB-CE2 4.17Å; P26-F191 HydrophobicContact CG-CD2 3.86Å; P26-F191 HydrophobicContact CG-CE2 3.79Å; P26-F191 HydrophobicContact CG-CG 4.35Å; P26-F191 HydrophobicContact CG-CZ 4.21Å; P26-F191 WeakPolarHBondContact O-CD2 3.21Å; P26-F191 WeakPolarHBondContact O-CE2 3.41Å
27	A	90.3	Very high	79.7	Confident	75 Å²	75	94.3 Å²	94.3	62%	0.62	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-70.8	141.3	172.8	0	0	0	0	0	110.1	M25 Q29	M25-A27 PolarHBondContact O-N 3.16Å; A27-Q29 PolarHBondContact O-N 3.47Å
28	V	95.2	Very high	82.1	Confident	15 Å²	15	93.4 Å²	93.4	9%	0.091	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-68.9	131.4	172.2	-177	0	0	0	0	108.5	A56 A58 F175 I189 F191	V28-A56 HydrophobicContact CG1-CB 4.01Å; V28-A58 HydrophobicContact CB-CB 4.49Å; V28-A58 HydrophobicContact CG1-CB 4.04Å; V28-A58 HydrophobicContact CG2-CB 3.66Å; V28-F175 HydrophobicContact CB-CB 3.74Å; V28-F175 HydrophobicContact CB-CD2 4.38Å; V28-F175 HydrophobicContact CB-CG 4.12Å; V28-F175 HydrophobicContact CG1-CB 3.82Å; V28-F175 HydrophobicContact CG1-CD1 4.09Å; V28-F175 HydrophobicContact CG1-CD2 3.92Å; V28-F175 HydrophobicContact CG1-CG 3.66Å; V28-F175 WeakPolarHBondContact O-CD2 2.89Å; V28-I189 HydrophobicContact CG1-CD1 4.48Å; V28-I189 HydrophobicContact CG2-CB 4.08Å; V28-I189 HydrophobicContact CG2-CG2 4.02Å; V28-F191 HydrophobicContact CG2-CD2 4.11Å; V28-F191 HydrophobicContact CG2-CE2 3.73Å; V28-F191 HydrophobicContact CG2-CZ 4.37Å
29	Q	96.8	Very high	84.4	Confident	88 Å²	88	90.3 Å²	90.3	41%	0.411	48%	0.476	S	S	.	.			trans	-146.4	174.5	-178.6	62.6	-179.5	-8.1	0	0	109.6	A27 D31 N44 A56 S57	A27-Q29 PolarHBondContact O-N 3.47Å; Q29-D31 PolarHBondContact O-N 3.17Å; Q29-N44 PolarHBondContact OE1-O 2.96Å; Q29-A56 CarbonylContact O-C 3.53Å; Q29-A56 WeakPolarHBondContact O-CA 3.41Å; Q29-S57 PolarHBondContact N-OG 2.98Å; Q29-S57 VanDerWaalsContact N-OG 3.15Å; Q29-S57 PolarHBondContact O-N 2.82Å; Q29-S57 PolarHBondContact O-OG 3.49Å
30	L	98.5	Very high	86.6	Confident	3 Å²	3	85.9 Å²	85.9	2%	0.016	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	129.3	170	-64.7	176.8	0	0	0	110	T32 I41 G45 I48 C54 V163 C173 F175	L30-T32 PolarHBondContact O-N 3.41Å; L30-I41 HydrophobicContact CB-CD1 4.17Å; L30-I41 HydrophobicContact CB-CG2 4.18Å; L30-I41 HydrophobicContact CD1-CD1 3.69Å; L30-I41 HydrophobicContact CD1-CG2 4.43Å; L30-G45 WeakPolarHBondContact CB-O 3.14Å; L30-G45 WeakPolarHBondContact CG-O 3.13Å; L30-G45 PolarHBondContact N-O 3Å; L30-I48 HydrophobicContact CD1-CB 3.86Å; L30-I48 HydrophobicContact CD1-CG2 4.38Å; L30-C54 HydrophobicContact CD2-CB 4.44Å; L30-V163 HydrophobicContact CD1-CG1 4.49Å; L30-V163 HydrophobicContact CD2-CG1 3.62Å; L30-C173 HydrophobicContact CD2-CB 4.43Å; L30-C173 HydrophobicContact CG-CB 4.43Å; L30-F175 HydrophobicContact CD2-CE2 4.28Å; L30-F175 HydrophobicContact CD2-CZ 4.03Å; L30-F175 HydrophobicContact CG-CE2 4.43Å
31	D	97.7	Very high	88.5	Confident	33 Å²	33	80.6 Å²	80.6	18%	0.176	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	107.8	-174.7	-170.2	-11.4	0	0	0	111	Q29 Q33 H34 C54 L55	Q29-D31 PolarHBondContact O-N 3.17Å; D31-Q33 PolarHBondContact O-N 3.16Å; D31-Q33 WeakPolarHBondContact OD1-CB 3.38Å; D31-Q33 PolarHBondContact OD1-N 3.48Å; D31-H34 HydrophobicContact CB-CB 4.27Å; D31-H34 CarbonylContact O-C 3.54Å; D31-H34 VanDerWaalsContact O-C 3.28Å; D31-H34 PolarHBondContact O-N 3.16Å; D31-H34 IonicContact OD1-ND1 2.67Å; D31-H34 IonicContact OD2-CE1 3.95Å; D31-H34 IonicContact OD2-CG 3.03Å; D31-H34 IonicContact OD2-ND1 3.27Å; D31-H34 PolarHBondContact OD2-ND1 2.78Å; D31-C54 PolarHBondContact O-SG 3.49Å; D31-C54 VanDerWaalsContact O-SG 3.37Å; D31-L55 WeakPolarHBondContact CB-O 3.4Å; D31-L55 PolarHBondContact N-O 3.37Å
32	T	96.9	Very high	90.7	Very high	84 Å²	84	78.3 Å²	78.3	52%	0.515	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-8.8	179.5	59.1	0	0	0	0	113.7	L30 M35 I41	L30-T32 PolarHBondContact O-N 3.41Å; T32-M35 HydrophobicContact CG2-SD 4.44Å; T32-I41 HydrophobicContact CG2-CB 4.32Å; T32-I41 HydrophobicContact CG2-CG1 4.46Å; T32-I41 HydrophobicContact CG2-CG2 4.4Å
33	Q	97.2	Very high	92.5	Very high	155 Å²	155	75.1 Å²	75.1	72%	0.724	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	-15.3	169.6	-56.2	-58.3	-56.6	0	0	112.6	D31	D31-Q33 PolarHBondContact O-N 3.16Å; D31-Q33 WeakPolarHBondContact OD1-CB 3.38Å; D31-Q33 PolarHBondContact OD1-N 3.48Å
34	H	98.3	Very high	93.9	Very high	64 Å²	64	72.8 Å²	72.8	30%	0.296	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	66.9	-178.5	-60.5	100.9	0	0	0	110.2	D31 C54 L55 L88	D31-H34 HydrophobicContact CB-CB 4.27Å; D31-H34 CarbonylContact O-C 3.54Å; D31-H34 VanDerWaalsContact O-C 3.28Å; D31-H34 PolarHBondContact O-N 3.16Å; D31-H34 IonicContact OD1-ND1 2.67Å; D31-H34 IonicContact OD2-CE1 3.95Å; D31-H34 IonicContact OD2-CG 3.03Å; D31-H34 IonicContact OD2-ND1 3.27Å; D31-H34 PolarHBondContact OD2-ND1 2.78Å; H34-C54 WeakPolarHBondContact O-CA 3.38Å; H34-L55 HydrophobicContact CB-CB 4.16Å; H34-L55 HydrophobicContact CB-CD1 4.17Å; H34-L55 HydrophobicContact CB-CG 4.35Å; H34-L55 PolarHBondContact O-N 2.8Å; H34-L88 HydrophobicContact CB-CD1 4.49Å; H34-L88 WeakPolarHBondContact O-CD1 3.21Å
35	M	98.5	Very high	95.3	Very high	60 Å²	60	64.5 Å²	64.5	30%	0.296	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	157.3	177.5	60	179.2	-105.7	0	0	112.1	T32 V39 I41 G53 C54	T32-M35 HydrophobicContact CG2-SD 4.44Å; M35-V39 HydrophobicContact CB-CB 4.42Å; M35-V39 HydrophobicContact CB-CG1 4.38Å; M35-V39 HydrophobicContact CE-CB 4.03Å; M35-V39 HydrophobicContact CE-CG1 4.25Å; M35-V39 WeakPolarHBondContact CE-O 3.47Å; M35-I41 HydrophobicContact SD-CG1 3.75Å; M35-G53 CarbonylContact C-O 3.29Å; M35-G53 VanDerWaalsContact CA-O 3.29Å; M35-G53 WeakPolarHBondContact CA-O 3.37Å; M35-C54 HydrophobicContact CB-CB 3.95Å
36	G	98.5	Very high	96.5	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	36%	0.356	C	S	.	.			trans	-64.6	156.2	171.9	0	0	0	0	0	112.2	D38 V39 G53 N89	G36-D38 VanDerWaalsContact C-N 3.29Å; G36-D38 PolarHBondContact O-N 3.29Å; G36-V39 WeakPolarHBondContact O-CB 3.44Å; G36-V39 PolarHBondContact O-N 3.22Å; G36-G53 PolarHBondContact N-O 3.43Å; G36-N89 WeakPolarHBondContact CA-OD1 3.26Å
37	T	97.9	Very high	97.2	Very high	105 Å²	105	64.2 Å²	64.2	64%	0.644	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-34	-173.1	47.6	0	0	0	0	113.5	N89	T37-N89 PolarHBondContact N-OD1 2.87Å; T37-N89 PolarHBondContact OG1-OD1 2.86Å
38	D	98.3	Very high	97.6	Very high	109 Å²	109	60.7 Å²	60.7	58%	0.583	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	15.5	-176.1	-54.8	-66.4	0	0	0	112.4	G36 G50 T51	G36-D38 VanDerWaalsContact C-N 3.29Å; G36-D38 PolarHBondContact O-N 3.29Å; D38-G50 WeakPolarHBondContact O-CA 3.36Å; D38-T51 CarbonylContact C-O 3.6Å; D38-T51 VanDerWaalsContact C-O 3.29Å; D38-T51 WeakPolarHBondContact CB-O 3.37Å; D38-T51 PolarHBondContact O-N 3.29Å
39	V	98.5	Very high	97.7	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	143.3	173.3	172	0	0	0	0	110	M35 G36 I41 I48 G52	M35-V39 HydrophobicContact CB-CB 4.42Å; M35-V39 HydrophobicContact CB-CG1 4.38Å; M35-V39 HydrophobicContact CE-CB 4.03Å; M35-V39 HydrophobicContact CE-CG1 4.25Å; M35-V39 WeakPolarHBondContact CE-O 3.47Å; G36-V39 WeakPolarHBondContact O-CB 3.44Å; G36-V39 PolarHBondContact O-N 3.22Å; V39-I41 HydrophobicContact CG1-CD1 3.6Å; V39-I41 HydrophobicContact CG1-CG1 4.07Å; V39-I48 HydrophobicContact CG1-CD1 3.69Å; V39-I48 HydrophobicContact CG1-CG1 3.58Å; V39-I48 HydrophobicContact CG2-CD1 4.46Å; V39-G52 VanDerWaalsContact CG2-CA 3.44Å
40	V	98.5	Very high	97.8	Very high	76 Å²	76	58.7 Å²	58.7	46%	0.461	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126	172.4	-178.5	0	0	0	0	109	V42 C49	V40-V42 HydrophobicContact CG1-CG1 4.01Å; V40-C49 PolarHBondContact N-O 3.15Å; V40-C49 PolarHBondContact O-N 2.82Å
41	I	98.6	Very high	97.8	Very high	32 Å²	32	61.3 Å²	61.3	16%	0.164	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.8	179.3	-55.1	-60	0	0	0	109.9	L30 T32 M35 V39 R47 I48 C54	L30-I41 HydrophobicContact CB-CD1 4.17Å; L30-I41 HydrophobicContact CB-CG2 4.18Å; L30-I41 HydrophobicContact CD1-CD1 3.69Å; L30-I41 HydrophobicContact CD1-CG2 4.43Å; T32-I41 HydrophobicContact CG2-CB 4.32Å; T32-I41 HydrophobicContact CG2-CG1 4.46Å; T32-I41 HydrophobicContact CG2-CG2 4.4Å; M35-I41 HydrophobicContact SD-CG1 3.75Å; V39-I41 HydrophobicContact CG1-CD1 3.6Å; V39-I41 HydrophobicContact CG1-CG1 4.07Å; I41-R47 CarbonylContact C-O 3.52Å; I41-R47 WeakPolarHBondContact CA-O 3.13Å; I41-I48 HydrophobicContact CD1-CB 3.89Å; I41-I48 HydrophobicContact CD1-CD1 4.21Å; I41-I48 HydrophobicContact CD1-CG1 3.75Å; I41-C54 HydrophobicContact CD1-CB 4.33Å
42	V	97.7	Very high	97.8	Very high	64 Å²	64	59.8 Å²	59.8	39%	0.388	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	-172.4	179.7	-56.9	0	0	0	0	111.3	V40 N44 G45 R46 R47	V40-V42 HydrophobicContact CG1-CG1 4.01Å; V42-N44 VanDerWaalsContact C-N 3.31Å; V42-N44 PolarHBondContact O-N 2.9Å; V42-G45 PolarHBondContact O-N 3.43Å; V42-R46 PolarHBondContact O-N 2.86Å; V42-R46 VanDerWaalsContact O-N 3.16Å; V42-R47 HydrophobicContact CG2-CB 3.66Å; V42-R47 HydrophobicContact CG2-CG 3.73Å; V42-R47 PolarHBondContact N-O 3.4Å; V42-R47 PolarHBondContact O-N 3.42Å; V42-R47 VanDerWaalsContact O-N 3.08Å
43	K	96.1	Very high	97.9	Very high	86 Å²	86	55.8 Å²	55.8	37%	0.374	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	42.2	177.6	-163.7	177.4	172.5	176.2	0	112.8	R46 R47 D172	K43-R46 WeakPolarHBondContact O-CB 3.36Å; K43-R46 PolarHBondContact O-N 3.18Å; K43-R47 HydrophobicContact CB-CB 3.82Å; K43-R47 HydrophobicContact CD-CB 4.39Å; K43-D172 IonicContact NZ-OD1 3.41Å; K43-D172 IonicContact NZ-OD2 3.94Å; K43-D172 PolarHBondContact NZ-OD2 2.72Å
44	N	94.6	Very high	98	Very high	136 Å²	136	48.4 Å²	48.4	73%	0.727	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	53.6	-177.2	-55	-22.8	0	0	0	112.3	Q29 V42 R46	Q29-N44 PolarHBondContact OE1-O 2.96Å; V42-N44 VanDerWaalsContact C-N 3.31Å; V42-N44 PolarHBondContact O-N 2.9Å; N44-R46 VanDerWaalsContact C-N 3.32Å; N44-R46 PolarHBondContact O-N 3.45Å
45	G	96.3	Very high	98	Very high	9 Å²	9	45.5 Å²	45.5	9%	0.093	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	16	176.9	0	0	0	0	0	114.8	L30 V42	L30-G45 WeakPolarHBondContact CB-O 3.14Å; L30-G45 WeakPolarHBondContact CG-O 3.13Å; L30-G45 PolarHBondContact N-O 3Å; V42-G45 PolarHBondContact O-N 3.43Å
46	R	97.6	Very high	98	Very high	82 Å²	82	42.7 Å²	42.7	31%	0.309	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	0.7	-172.9	-63.1	-172.5	-65.6	-170.2	-1.9	114.9	V42 K43 N44 D172 C173	V42-R46 PolarHBondContact O-N 2.86Å; V42-R46 VanDerWaalsContact O-N 3.16Å; K43-R46 WeakPolarHBondContact O-CB 3.36Å; K43-R46 PolarHBondContact O-N 3.18Å; N44-R46 VanDerWaalsContact C-N 3.32Å; N44-R46 PolarHBondContact O-N 3.45Å; R46-D172 CarbonylContact O-C 3.58Å; R46-D172 VanDerWaalsContact O-CA 3.31Å; R46-D172 WeakPolarHBondContact O-CA 3.42Å; R46-C173 PolarHBondContact O-N 3.37Å
47	R	98.6	Very high	97.9	Very high	66 Å²	66	44.1 Å²	44.1	25%	0.249	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.2	175.3	177.4	170.9	-67.1	-168.6	-6.4	110	I41 V42 K43 I170 L171 D172	I41-R47 CarbonylContact C-O 3.52Å; I41-R47 WeakPolarHBondContact CA-O 3.13Å; V42-R47 HydrophobicContact CG2-CB 3.66Å; V42-R47 HydrophobicContact CG2-CG 3.73Å; V42-R47 PolarHBondContact N-O 3.4Å; V42-R47 PolarHBondContact O-N 3.42Å; V42-R47 VanDerWaalsContact O-N 3.08Å; K43-R47 HydrophobicContact CB-CB 3.82Å; K43-R47 HydrophobicContact CD-CB 4.39Å; R47-I170 HydrophobicContact CG-CG2 3.87Å; R47-L171 WeakPolarHBondContact CA-O 3.33Å; R47-D172 WeakPolarHBondContact CB-OD1 3.27Å; R47-D172 IonicContact CZ-OD1 2.83Å; R47-D172 VanDerWaalsContact CZ-OD1 3.27Å; R47-D172 IonicContact CZ-OD2 3.57Å; R47-D172 IonicContact NE-OD1 3.5Å; R47-D172 PolarHBondContact NE-OD1 2.87Å; R47-D172 IonicContact NE-OD2 3.62Å; R47-D172 VanDerWaalsContact NH2-CG 3.3Å; R47-D172 IonicContact NH2-OD1 3.65Å; R47-D172 PolarHBondContact NH2-OD1 3.45Å; R47-D172 IonicContact NH2-OD2 3.61Å; R47-D172 PolarHBondContact NH2-OD2 2.78Å
48	I	98.8	Very high	97.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.2	176.9	-172.3	174.7	0	0	0	110.5	L30 V39 I41 C54 V163 V165 I170 L171	L30-I48 HydrophobicContact CD1-CB 3.86Å; L30-I48 HydrophobicContact CD1-CG2 4.38Å; V39-I48 HydrophobicContact CG1-CD1 3.69Å; V39-I48 HydrophobicContact CG1-CG1 3.58Å; V39-I48 HydrophobicContact CG2-CD1 4.46Å; I41-I48 HydrophobicContact CD1-CB 3.89Å; I41-I48 HydrophobicContact CD1-CD1 4.21Å; I41-I48 HydrophobicContact CD1-CG1 3.75Å; I48-C54 HydrophobicContact CD1-CB 3.83Å; I48-V163 HydrophobicContact CD1-CG1 3.93Å; I48-V163 HydrophobicContact CG2-CG1 3.97Å; I48-V163 HydrophobicContact CG2-CG2 3.8Å; I48-V165 HydrophobicContact CD1-CG2 4Å; I48-V165 HydrophobicContact CG1-CG1 4.42Å; I48-V165 HydrophobicContact CG1-CG2 3.72Å; I48-V165 HydrophobicContact CG2-CG1 3.9Å; I48-I170 WeakPolarHBondContact O-CA 3.46Å; I48-L171 HydrophobicContact CG2-CB 3.91Å; I48-L171 PolarHBondContact N-O 2.64Å; I48-L171 PolarHBondContact O-N 2.78Å; I48-L171 VanDerWaalsContact O-N 3.12Å
49	C	98.4	Very high	97.7	Very high	32 Å²	32	35 Å²	35	22%	0.216	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	178.1	169.1	57.5	0	0	0	0	109.9	V40 I170	V40-C49 PolarHBondContact N-O 3.15Å; V40-C49 PolarHBondContact O-N 2.82Å; C49-I170 HydrophobicContact CB-CG1 4Å; C49-I170 HydrophobicContact CB-CG2 4.49Å
50	G	98.2	Very high	97.6	Very high	29 Å²	29	35.3 Å²	35.3	30%	0.299	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	95	-147.2	-174.7	0	0	0	0	0	112	D38 V165	D38-G50 WeakPolarHBondContact O-CA 3.36Å; G50-V165 WeakPolarHBondContact O-CG2 3.42Å
51	T	98.7	Very high	97.1	Very high	59 Å²	59	36 Å²	36	36%	0.362	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	118.6	179.9	-62.8	0	0	0	0	110.6	D38 V165 D166	D38-T51 CarbonylContact C-O 3.6Å; D38-T51 VanDerWaalsContact C-O 3.29Å; D38-T51 WeakPolarHBondContact CB-O 3.37Å; D38-T51 PolarHBondContact O-N 3.29Å; T51-V165 CarbonylContact C-O 3.53Å; T51-V165 WeakPolarHBondContact CA-O 3.2Å; T51-D166 HydrophobicContact CG2-CB 4.22Å; T51-D166 VanDerWaalsContact CG2-OD1 3.27Å; T51-D166 WeakPolarHBondContact CG2-OD1 3.43Å; T51-D166 PolarHBondContact OG1-OD1 3.15Å
52	G	98.7	Very high	96.4	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135.3	-176.7	178.5	0	0	0	0	0	113.6	V39 L88 Y164 V165	V39-G52 VanDerWaalsContact CG2-CA 3.44Å; G52-L88 CarbonylContact C-O 3.5Å; G52-L88 WeakPolarHBondContact CA-O 3.36Å; G52-Y164 CarbonylContact O-C 3.59Å; G52-Y164 VanDerWaalsContact O-CA 3.23Å; G52-Y164 WeakPolarHBondContact O-CA 3.38Å; G52-Y164 WeakPolarHBondContact O-CB 3.31Å; G52-V165 PolarHBondContact N-O 3.31Å; G52-V165 PolarHBondContact O-N 3.31Å
53	G	98.8	Very high	95.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	164	179.2	0	0	0	0	0	113.7	M35 G36 L88 V163	M35-G53 CarbonylContact C-O 3.29Å; M35-G53 VanDerWaalsContact CA-O 3.29Å; M35-G53 WeakPolarHBondContact CA-O 3.37Å; G36-G53 PolarHBondContact N-O 3.43Å; G53-L88 PolarHBondContact N-O 2.96Å; G53-V163 CarbonylContact C-O 3.5Å; G53-V163 WeakPolarHBondContact CA-O 3.47Å
54	C	98.9	Very high	95.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	137.7	170.7	-176.2	0	0	0	0	110.2	L30 D31 H34 M35 I41 I48 V162 V163	L30-C54 HydrophobicContact CD2-CB 4.44Å; D31-C54 PolarHBondContact O-SG 3.49Å; D31-C54 VanDerWaalsContact O-SG 3.37Å; H34-C54 WeakPolarHBondContact O-CA 3.38Å; M35-C54 HydrophobicContact CB-CB 3.95Å; I41-C54 HydrophobicContact CD1-CB 4.33Å; I48-C54 HydrophobicContact CD1-CB 3.83Å; C54-V162 WeakPolarHBondContact O-CA 3.27Å; C54-V163 PolarHBondContact N-O 2.89Å; C54-V163 PolarHBondContact O-N 2.93Å; C54-V163 VanDerWaalsContact O-N 3.09Å
55	L	98.8	Very high	95.9	Very high	2 Å²	2	32 Å²	32	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	153.8	171.1	-60.3	180	0	0	0	110.4	D31 H34 A82 Q84 V86 L88 P161 V162	D31-L55 WeakPolarHBondContact CB-O 3.4Å; D31-L55 PolarHBondContact N-O 3.37Å; H34-L55 HydrophobicContact CB-CB 4.16Å; H34-L55 HydrophobicContact CB-CD1 4.17Å; H34-L55 HydrophobicContact CB-CG 4.35Å; H34-L55 PolarHBondContact O-N 2.8Å; L55-A82 HydrophobicContact CD2-CB 3.89Å; L55-Q84 HydrophobicContact CD1-CG 4.14Å; L55-V86 HydrophobicContact CD2-CG1 4.18Å; L55-L88 HydrophobicContact CD2-CD2 4.43Å; L55-L88 HydrophobicContact CG-CD1 4.37Å; L55-L88 HydrophobicContact CG-CD2 4.45Å; L55-P161 CarbonylContact C-O 3.6Å; L55-P161 WeakPolarHBondContact CA-O 3.33Å; L55-V162 HydrophobicContact CD2-CB 3.82Å; L55-V162 HydrophobicContact CD2-CG2 3.78Å
56	A	98.3	Very high	96	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	158.7	163.1	0	0	0	0	0	111.2	V28 Q29 A58 Y160 P161 F175	V28-A56 HydrophobicContact CG1-CB 4.01Å; Q29-A56 CarbonylContact O-C 3.53Å; Q29-A56 WeakPolarHBondContact O-CA 3.41Å; A56-A58 VanDerWaalsContact C-N 3.26Å; A56-A58 PolarHBondContact O-N 2.82Å; A56-Y160 WeakPolarHBondContact O-CD1 3.29Å; A56-P161 HydrophobicContact CB-CB 3.84Å; A56-P161 HydrophobicContact CB-CG 3.8Å; A56-P161 PolarHBondContact N-O 2.8Å; A56-F175 HydrophobicContact CB-CD1 4.38Å; A56-F175 HydrophobicContact CB-CE1 3.69Å; A56-F175 HydrophobicContact CB-CE2 4.19Å; A56-F175 HydrophobicContact CB-CZ 3.56Å
57	S	96.4	Very high	96.1	Very high	30 Å²	30	27.8 Å²	27.8	21%	0.21	15%	0.15	C	C	.	.	S	Bend	trans	-73.7	-9.9	-175.8	57.4	0	0	0	0	115.2	Q29 F191	Q29-S57 PolarHBondContact N-OG 2.98Å; Q29-S57 VanDerWaalsContact N-OG 3.15Å; Q29-S57 PolarHBondContact O-N 2.82Å; Q29-S57 PolarHBondContact O-OG 3.49Å; S57-F191 WeakPolarHBondContact O-CE1 3.42Å
58	A	95.4	Very high	96.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-123.7	136.2	-179.3	0	0	0	0	0	111.7	V28 A56 Y160 I189 F191	V28-A58 HydrophobicContact CB-CB 4.49Å; V28-A58 HydrophobicContact CG1-CB 4.04Å; V28-A58 HydrophobicContact CG2-CB 3.66Å; A56-A58 VanDerWaalsContact C-N 3.26Å; A56-A58 PolarHBondContact O-N 2.82Å; A58-Y160 VanDerWaalsContact C-CD1 3.43Å; A58-Y160 WeakPolarHBondContact O-CD1 3.36Å; A58-I189 HydrophobicContact CB-CG2 3.78Å; A58-F191 HydrophobicContact CB-CD1 4.01Å; A58-F191 HydrophobicContact CB-CE1 3.73Å; A58-F191 HydrophobicContact CB-CE2 4.26Å; A58-F191 HydrophobicContact CB-CG 4.4Å; A58-F191 HydrophobicContact CB-CZ 3.87Å
59	P	96.1	Very high	96	Very high	22 Å²	22	24.7 Å²	24.7	14%	0.143	14%	0.138	C	C	.	.			trans	-73	158.2	171.8	30.9	-33.3	0	0	0	111.5	H61 T158 V159 Y160	P59-H61 VanDerWaalsContact C-N 3.34Å; P59-H61 WeakPolarHBondContact CB-NE2 3.42Å; P59-H61 VanDerWaalsContact CG-CE1 3.44Å; P59-H61 WeakPolarHBondContact CG-CE1 3.16Å; P59-H61 WeakPolarHBondContact CG-NE2 3.43Å; P59-H61 PolarHBondContact O-N 2.89Å; P59-H61 VanDerWaalsContact O-N 3.16Å; P59-T158 HydrophobicContact CB-CG2 3.51Å; P59-T158 HydrophobicContact CG-CG2 4.48Å; P59-V159 WeakPolarHBondContact CA-O 3.42Å; P59-Y160 HydrophobicContact CB-CD1 4.13Å; P59-Y160 HydrophobicContact CB-CE1 3.66Å; P59-Y160 HydrophobicContact CB-CE2 4.04Å; P59-Y160 HydrophobicContact CG-CE1 4.14Å; P59-Y160 VanDerWaalsContact N-CE1 3.29Å
60	L	95.4	Very high	96.1	Very high	15 Å²	15	25.8 Å²	25.8	8%	0.079	14%	0.14	C	C	.	.			trans	-87.2	71.2	173.5	-54.9	-175.3	0	0	0	110.4	F67 V81 Y134 V159 P161 I189	L60-F67 HydrophobicContact CD1-CE1 4.03Å; L60-V81 HydrophobicContact CD1-CG1 3.6Å; L60-Y134 HydrophobicContact CB-CD1 4.16Å; L60-Y134 HydrophobicContact CD1-CD1 3.63Å; L60-Y134 HydrophobicContact CD1-CE1 4.4Å; L60-Y134 HydrophobicContact CD1-CG 3.79Å; L60-V159 HydrophobicContact CB-CG2 4.21Å; L60-V159 HydrophobicContact CD1-CG2 4.23Å; L60-V159 HydrophobicContact CG-CG2 4.49Å; L60-V159 PolarHBondContact N-O 2.96Å; L60-P161 HydrophobicContact CD2-CG 3.89Å; L60-P161 HydrophobicContact CG-CG 4.41Å; L60-I189 HydrophobicContact CD2-CD1 3.58Å; L60-I189 HydrophobicContact CD2-CG1 3.73Å; L60-I189 HydrophobicContact CD2-CG2 4.19Å
61	H	89.4	Confident	96.1	Very high	89 Å²	89	24.5 Å²	24.5	41%	0.412	13%	0.126	S	C	.	.			trans	-81.5	-27.8	176.3	-68.2	175.5	0	0	0	113.1	P59 T158 E192	P59-H61 VanDerWaalsContact C-N 3.34Å; P59-H61 WeakPolarHBondContact CB-NE2 3.42Å; P59-H61 VanDerWaalsContact CG-CE1 3.44Å; P59-H61 WeakPolarHBondContact CG-CE1 3.16Å; P59-H61 WeakPolarHBondContact CG-NE2 3.43Å; P59-H61 PolarHBondContact O-N 2.89Å; P59-H61 VanDerWaalsContact O-N 3.16Å; H61-T158 WeakPolarHBondContact NE2-CG2 3.43Å; H61-E192 WeakPolarHBondContact CB-OE1 3.48Å; H61-E192 IonicContact CE1-OE1 3.8Å; H61-E192 IonicContact CE1-OE2 3.96Å; H61-E192 IonicContact CG-OE1 2.84Å; H61-E192 IonicContact ND1-OE1 3.82Å; H61-E192 PolarHBondContact ND1-OE1 3.5Å; H61-E192 IonicContact ND1-OE2 3.52Å; H61-E192 PolarHBondContact ND1-OE2 2.78Å
62	Q	84	Confident	96.1	Very high	46 Å²	46	24.9 Å²	24.9	22%	0.215	12%	0.123	C	C	.	.	S	Bend	trans	-77.9	146.1	176.5	70.3	-162.2	58	0	0	111.2	S65 K188	Q62-S65 WeakPolarHBondContact CG-OG 3.41Å; Q62-S65 PolarHBondContact O-OG 3.28Å; Q62-K188 PolarHBondContact NE2-O 2.84Å
63	N	85.8	Confident	96.1	Very high	105 Å²	105	26.6 Å²	26.6	56%	0.561	14%	0.135	S	C	*	.	S	Bend	trans	-68.6	151.8	165.9	-66.9	-27.9	0	0	0	109.7
64	K	95.1	Very high	95.9	Very high	85 Å²	85	29.5 Å²	29.5	37%	0.37	15%	0.153	S	C	.	.	S	Bend	trans	54.1	62.8	176.2	-55.4	-176.7	-179.8	-177.3	0	114.6	Y134 D135 G185 F186 E187	K64-Y134 CarbonylContact C-O 3.5Å; K64-Y134 WeakPolarHBondContact CA-O 3.32Å; K64-Y134 PolarHBondContact N-O 3.03Å; K64-D135 WeakPolarHBondContact CE-OD2 3.46Å; K64-D135 HydrophobicContact CG-CB 4.14Å; K64-D135 VanDerWaalsContact CG-CG 3.43Å; K64-D135 WeakPolarHBondContact CG-OD1 3.18Å; K64-D135 WeakPolarHBondContact CG-OD2 3.48Å; K64-D135 PolarHBondContact N-OD1 2.94Å; K64-G185 WeakPolarHBondContact CB-O 3.25Å; K64-G185 WeakPolarHBondContact CD-O 3.45Å; K64-F186 VanDerWaalsContact CA-CD1 3.4Å; K64-F186 HydrophobicContact CB-CB 4.43Å; K64-F186 HydrophobicContact CB-CD1 3.58Å; K64-F186 HydrophobicContact CB-CD2 4.37Å; K64-F186 HydrophobicContact CB-CE1 3.78Å; K64-F186 HydrophobicContact CB-CG 3.89Å; K64-F186 HydrophobicContact CB-CZ 4.29Å; K64-F186 HydrophobicContact CG-CD1 4.32Å; K64-F186 HydrophobicContact CG-CE1 4.07Å; K64-F186 HydrophobicContact CG-CE2 4.46Å; K64-F186 HydrophobicContact CG-CZ 4.15Å; K64-F186 VanDerWaalsContact O-CA 3.27Å; K64-F186 WeakPolarHBondContact O-CA 3.29Å; K64-E187 PolarHBondContact O-N 2.9Å
65	S	97.2	Very high	95.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	145.1	172.8	-60.2	0	0	0	0	112.1	Q62 T133 Y134 F186 E187	Q62-S65 WeakPolarHBondContact CG-OG 3.41Å; Q62-S65 PolarHBondContact O-OG 3.28Å; S65-T133 WeakPolarHBondContact O-CA 3.43Å; S65-Y134 PolarHBondContact N-O 2.77Å; S65-Y134 PolarHBondContact O-N 2.8Å; S65-F186 WeakPolarHBondContact O-CD1 3.49Å; S65-E187 CarbonylContact C-O 3.55Å
66	Y	98.2	Very high	95.8	Very high	2 Å²	2	33 Å²	33	1%	0.008	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	140.3	175	-174.6	-105.3	0	0	0	112.6	E68 I132 T133 F178 P182 E187	Y66-E68 HydrophobicContact CD1-CG 4.42Å; Y66-E68 HydrophobicContact CE1-CG 3.45Å; Y66-E68 VanDerWaalsContact CE1-CG 3.45Å; Y66-E68 WeakPolarHBondContact OH-CG 2.96Å; Y66-E68 PolarHBondContact OH-OE1 3.33Å; Y66-I132 WeakPolarHBondContact CA-O 3.31Å; Y66-I132 WeakPolarHBondContact CD2-O 3.33Å; Y66-T133 HydrophobicContact CD2-CG2 3.73Å; Y66-T133 HydrophobicContact CE2-CG2 4.3Å; Y66-F178 AromaticContact CD1-CD1 3.94Å; Y66-F178 HydrophobicContact CD1-CD1 3.94Å; Y66-F178 AromaticContact CD1-CD2 3.81Å; Y66-F178 HydrophobicContact CD1-CD2 3.81Å; Y66-F178 AromaticContact CD1-CE1 3.92Å; Y66-F178 HydrophobicContact CD1-CE1 3.92Å; Y66-F178 AromaticContact CD1-CE2 3.77Å; Y66-F178 HydrophobicContact CD1-CE2 3.77Å; Y66-F178 AromaticContact CD1-CG 3.89Å; Y66-F178 HydrophobicContact CD1-CG 3.89Å; Y66-F178 AromaticContact CD1-CZ 3.83Å; Y66-F178 HydrophobicContact CD1-CZ 3.83Å; Y66-F178 HydrophobicContact CE1-CB 4.19Å; Y66-F178 AromaticContact CE1-CD1 3.98Å; Y66-F178 HydrophobicContact CE1-CD1 3.98Å; Y66-F178 HydrophobicContact CE1-CD2 4.1Å; Y66-F178 HydrophobicContact CE1-CE1 4.4Å; Y66-F178 AromaticContact CE1-CG 3.81Å; Y66-F178 HydrophobicContact CE1-CG 3.81Å; Y66-F178 VanDerWaalsContact O-CZ 3.31Å; Y66-F178 WeakPolarHBondContact O-CZ 3.46Å; Y66-P182 HydrophobicContact CD1-CB 3.81Å; Y66-P182 HydrophobicContact CD1-CG 3.61Å; Y66-P182 HydrophobicContact CE1-CB 4.3Å; Y66-P182 HydrophobicContact CE1-CG 4.04Å; Y66-P182 HydrophobicContact CG-CB 3.95Å; Y66-P182 HydrophobicContact CG-CG 4.24Å; Y66-E187 PolarHBondContact N-O 2.95Å
67	F	98.5	Very high	95.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	155.1	174.8	51.4	-84.3	0	0	0	110.8	L60 F69 V81 I132 P161 F175 I189	L60-F67 HydrophobicContact CD1-CE1 4.03Å; F67-F69 HydrophobicContact CD2-CD2 4.38Å; F67-F69 AromaticContact CD2-CE2 3.3Å; F67-F69 HydrophobicContact CD2-CE2 3.3Å; F67-F69 AromaticContact CD2-CZ 3.48Å; F67-F69 HydrophobicContact CD2-CZ 3.48Å; F67-F69 VanDerWaalsContact CD2-CZ 3.48Å; F67-F69 AromaticContact CE2-CE2 3.48Å; F67-F69 HydrophobicContact CE2-CE2 3.48Å; F67-F69 VanDerWaalsContact CE2-CE2 3.48Å; F67-F69 AromaticContact CE2-CZ 3.67Å; F67-F69 HydrophobicContact CE2-CZ 3.67Å; F67-V81 HydrophobicContact CZ-CG1 4.08Å; F67-I132 HydrophobicContact CD2-CB 4.01Å; F67-I132 HydrophobicContact CD2-CG1 4.45Å; F67-I132 HydrophobicContact CE1-CB 4.25Å; F67-I132 HydrophobicContact CE1-CG2 3.97Å; F67-I132 HydrophobicContact CE2-CB 3.57Å; F67-I132 HydrophobicContact CE2-CG1 3.95Å; F67-I132 HydrophobicContact CE2-CG2 3.78Å; F67-I132 HydrophobicContact CZ-CB 3.7Å; F67-I132 HydrophobicContact CZ-CG1 4.45Å; F67-I132 HydrophobicContact CZ-CG2 3.41Å; F67-I132 VanDerWaalsContact CZ-CG2 3.41Å; F67-I132 PolarHBondContact N-O 3.23Å; F67-I132 VanDerWaalsContact N-O 3.14Å; F67-I132 PolarHBondContact O-N 3.46Å; F67-P161 HydrophobicContact CD1-CB 4.47Å; F67-P161 HydrophobicContact CD1-CG 4.13Å; F67-P161 HydrophobicContact CD2-CB 4.02Å; F67-P161 HydrophobicContact CE1-CB 4.26Å; F67-P161 HydrophobicContact CE1-CG 4.05Å; F67-P161 HydrophobicContact CE2-CB 3.76Å; F67-P161 HydrophobicContact CE2-CG 4.41Å; F67-P161 HydrophobicContact CG-CB 4.36Å; F67-P161 HydrophobicContact CG-CG 4.37Å; F67-P161 HydrophobicContact CZ-CB 3.9Å; F67-P161 HydrophobicContact CZ-CG 4.18Å; F67-F175 HydrophobicContact CB-CD1 3.84Å; F67-F175 HydrophobicContact CB-CE1 4.34Å; F67-F175 HydrophobicContact CG-CD1 4.5Å; F67-I189 HydrophobicContact CB-CD1 4.35Å; F67-I189 HydrophobicContact CD1-CD1 3.99Å; F67-I189 HydrophobicContact CG-CD1 4.4Å
68	E	98.4	Very high	95.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.6	-174.5	-63.1	-179.7	147.9	0	0	112.8	Y66 V129 V130 Q174 F178 Y179 H180	Y66-E68 HydrophobicContact CD1-CG 4.42Å; Y66-E68 HydrophobicContact CE1-CG 3.45Å; Y66-E68 VanDerWaalsContact CE1-CG 3.45Å; Y66-E68 WeakPolarHBondContact OH-CG 2.96Å; Y66-E68 PolarHBondContact OH-OE1 3.33Å; E68-V129 HydrophobicContact CB-CG1 3.85Å; E68-V129 HydrophobicContact CG-CG1 4.12Å; E68-V130 CarbonylContact C-O 3.58Å; E68-V130 WeakPolarHBondContact CA-O 3.36Å; E68-Q174 HydrophobicContact CB-CB 4.3Å; E68-Q174 PolarHBondContact N-O 3.29Å; E68-Q174 PolarHBondContact O-N 2.79Å; E68-F178 HydrophobicContact CG-CB 4.47Å; E68-F178 HydrophobicContact CG-CD1 4.06Å; E68-F178 WeakPolarHBondContact OE2-CA 3.36Å; E68-F178 WeakPolarHBondContact OE2-CB 3.34Å; E68-Y179 PolarHBondContact OE2-N 2.9Å; E68-H180 WeakPolarHBondContact OE1-CA 3.18Å; E68-H180 VanDerWaalsContact OE1-CB 3.29Å; E68-H180 WeakPolarHBondContact OE1-CB 3.39Å; E68-H180 IonicContact OE1-CD2 2.64Å; E68-H180 IonicContact OE1-CG 2.95Å; E68-H180 PolarHBondContact OE1-N 2.82Å
69	F	98.7	Very high	96.1	Very high	1 Å²	1	31.7 Å²	31.7	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.9	174.5	-53.7	-92.1	0	0	0	109.8	F67 I79 V129 V130 I132 V163 L171 D172 C173	F67-F69 HydrophobicContact CD2-CD2 4.38Å; F67-F69 AromaticContact CD2-CE2 3.3Å; F67-F69 HydrophobicContact CD2-CE2 3.3Å; F67-F69 AromaticContact CD2-CZ 3.48Å; F67-F69 HydrophobicContact CD2-CZ 3.48Å; F67-F69 VanDerWaalsContact CD2-CZ 3.48Å; F67-F69 AromaticContact CE2-CE2 3.48Å; F67-F69 HydrophobicContact CE2-CE2 3.48Å; F67-F69 VanDerWaalsContact CE2-CE2 3.48Å; F67-F69 AromaticContact CE2-CZ 3.67Å; F67-F69 HydrophobicContact CE2-CZ 3.67Å; F69-I79 HydrophobicContact CB-CD1 4.26Å; F69-I79 HydrophobicContact CB-CG2 4.08Å; F69-I79 HydrophobicContact CD1-CG2 3.74Å; F69-I79 HydrophobicContact CD2-CB 3.76Å; F69-I79 HydrophobicContact CD2-CD1 3.45Å; F69-I79 VanDerWaalsContact CD2-CD1 3.45Å; F69-I79 HydrophobicContact CD2-CG1 4.2Å; F69-I79 HydrophobicContact CD2-CG2 3.65Å; F69-I79 HydrophobicContact CE1-CG2 4.03Å; F69-I79 HydrophobicContact CE2-CB 3.69Å; F69-I79 HydrophobicContact CE2-CD1 4.04Å; F69-I79 HydrophobicContact CE2-CG1 4.41Å; F69-I79 HydrophobicContact CE2-CG2 3.89Å; F69-I79 HydrophobicContact CG-CB 4.2Å; F69-I79 HydrophobicContact CG-CD1 4.11Å; F69-I79 HydrophobicContact CG-CG2 3.54Å; F69-I79 HydrophobicContact CZ-CB 4.13Å; F69-I79 HydrophobicContact CZ-CG2 4.08Å; F69-V129 CarbonylContact O-C 3.46Å; F69-V129 WeakPolarHBondContact O-CA 3.48Å; F69-V130 PolarHBondContact N-O 3.49Å; F69-V130 PolarHBondContact O-N 2.86Å; F69-I132 HydrophobicContact CD2-CG1 4.42Å; F69-I132 HydrophobicContact CE2-CG1 4.06Å; F69-V163 HydrophobicContact CD1-CB 4.22Å; F69-V163 HydrophobicContact CD1-CG2 4.28Å; F69-V163 HydrophobicContact CE1-CB 3.78Å; F69-V163 HydrophobicContact CE1-CG1 4.31Å; F69-V163 HydrophobicContact CE1-CG2 4.34Å; F69-L171 HydrophobicContact CB-CD2 4.29Å; F69-D172 CarbonylContact C-O 3.51Å; F69-D172 VanDerWaalsContact CA-O 3.25Å; F69-D172 WeakPolarHBondContact CA-O 3.42Å; F69-C173 HydrophobicContact CD1-CB 4.09Å; F69-C173 HydrophobicContact CE1-CB 4.14Å
70	K	98.8	Very high	96.2	Very high	55 Å²	55	30.6 Å²	30.6	24%	0.239	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124	172.6	-179.3	170.6	-177.2	168.4	0	109.8	Q72 D128 V129 L171 D172 Y179	K70-Q72 PolarHBondContact O-N 2.91Å; K70-D128 WeakPolarHBondContact CA-O 3.25Å; K70-V129 HydrophobicContact CB-CG2 4.14Å; K70-V129 HydrophobicContact CD-CG2 4.33Å; K70-V129 HydrophobicContact CG-CG2 4.16Å; K70-L171 WeakPolarHBondContact O-CA 3.36Å; K70-D172 HydrophobicContact CB-CB 4.2Å; K70-D172 PolarHBondContact N-O 3.16Å; K70-D172 PolarHBondContact O-N 3.13Å; K70-Y179 HydrophobicContact CB-CE2 3.96Å; K70-Y179 HydrophobicContact CD-CE1 4.18Å; K70-Y179 HydrophobicContact CD-CE2 4.08Å
71	I	98.8	Very high	96.4	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	111.7	178.6	-56.6	168	0	0	0	107.5	T74 W77 P124 G127 D128 V130	I71-T74 HydrophobicContact CG2-CG2 3.98Å; I71-W77 HydrophobicContact CD1-CH2 3.87Å; I71-W77 HydrophobicContact CD1-CZ2 3.43Å; I71-W77 VanDerWaalsContact CD1-CZ2 3.43Å; I71-W77 HydrophobicContact CG1-CZ2 4.33Å; I71-P124 HydrophobicContact CD1-CB 3.47Å; I71-P124 VanDerWaalsContact CD1-CB 3.47Å; I71-G127 PolarHBondContact O-N 3.2Å; I71-D128 PolarHBondContact N-O 2.84Å; I71-V130 HydrophobicContact CD1-CG2 4.21Å
72	Q	98.6	Very high	96.8	Very high	68 Å²	68	25.7 Å²	25.7	32%	0.318	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-36.6	179	-66.6	-71.8	-21	0	0	111.5	K70 I170 D172	K70-Q72 PolarHBondContact O-N 2.91Å; Q72-I170 WeakPolarHBondContact CA-O 3.44Å; Q72-I170 HydrophobicContact CB-CB 4.05Å; Q72-I170 HydrophobicContact CB-CG2 3.91Å; Q72-I170 WeakPolarHBondContact CB-O 3.41Å; Q72-I170 HydrophobicContact CG-CG2 4.49Å; Q72-I170 PolarHBondContact N-O 3.08Å; Q72-D172 HydrophobicContact CG-CB 4.4Å; Q72-D172 PolarHBondContact NE2-OD2 3.34Å
73	S	98.3	Very high	97.5	Very high	36 Å²	36	24 Å²	24	25%	0.252	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	137.5	169.4	-169.6	0	0	0	0	109.5	E126 A169 I170	S73-E126 VanDerWaalsContact CA-OE1 3.31Å; S73-E126 WeakPolarHBondContact CA-OE1 3.39Å; S73-E126 PolarHBondContact OG-OE1 3.04Å; S73-A169 WeakPolarHBondContact O-CA 3.49Å; S73-I170 PolarHBondContact N-O 2.97Å; S73-I170 VanDerWaalsContact N-O 3.16Å; S73-I170 PolarHBondContact O-N 3.11Å
74	T	94.9	Very high	98.1	Very high	62 Å²	62	24.1 Å²	24.1	38%	0.38	13%	0.126	S	C	.	.			trans	-76.2	162.9	176.4	50	0	0	0	0	111.3	I71 E126	I71-T74 HydrophobicContact CG2-CG2 3.98Å; T74-E126 HydrophobicContact CG2-CB 4.48Å; T74-E126 HydrophobicContact CG2-CG 3.43Å; T74-E126 VanDerWaalsContact CG2-CG 3.43Å; T74-E126 PolarHBondContact N-OE1 2.81Å; T74-E126 PolarHBondContact OG1-OE1 2.8Å
75	G	96.8	Very high	98.2	Very high	19 Å²	19	27.7 Å²	27.7	20%	0.196	14%	0.141	C	C	.	.	S	Bend	trans	160.3	-148.5	-169.7	0	0	0	0	0	107.1	D167	G75-D167 WeakPolarHBondContact CA-O 3.42Å
76	I	98.3	Very high	98.3	Very high	55 Å²	55	28.2 Å²	28.2	28%	0.282	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	123.2	171	-65.1	171.5	0	0	0	108.3	I91 Y164 V165 D166 D167 A169	I76-I91 HydrophobicContact CG2-CG2 4.09Å; I76-Y164 HydrophobicContact CG2-CE2 4Å; I76-V165 CarbonylContact O-C 3.53Å; I76-V165 WeakPolarHBondContact O-CA 3.46Å; I76-D166 HydrophobicContact CB-CB 3.93Å; I76-D166 HydrophobicContact CG2-CB 4.07Å; I76-D166 PolarHBondContact N-O 2.77Å; I76-D166 PolarHBondContact O-N 2.9Å; I76-D167 HydrophobicContact CB-CB 4.33Å; I76-D167 HydrophobicContact CD1-CB 4.07Å; I76-D167 HydrophobicContact CG1-CB 4.02Å; I76-A169 VanDerWaalsContact O-CB 3.29Å; I76-A169 WeakPolarHBondContact O-CB 3.38Å
77	W	98.7	Very high	98.3	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.015	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	165.5	177.7	58.4	-92.7	0	0	0	110.8	I71 I79 M102 R103 N104 P124 V130 Y164 A169 L171	I71-W77 HydrophobicContact CD1-CH2 3.87Å; I71-W77 HydrophobicContact CD1-CZ2 3.43Å; I71-W77 VanDerWaalsContact CD1-CZ2 3.43Å; I71-W77 HydrophobicContact CG1-CZ2 4.33Å; W77-I79 HydrophobicContact CE3-CG2 4.49Å; W77-I79 HydrophobicContact CZ3-CD1 4.38Å; W77-I79 HydrophobicContact CZ3-CG1 4.15Å; W77-M102 HydrophobicContact CH2-CE 3.56Å; W77-M102 HydrophobicContact CZ3-CE 3.58Å; W77-R103 CarbonylContact O-C 3.59Å; W77-N104 HydrophobicContact CD2-CB 3.89Å; W77-N104 HydrophobicContact CG-CB 3.95Å; W77-N104 HydrophobicContact CZ2-CB 4.08Å; W77-N104 PolarHBondContact O-N 2.94Å; W77-P124 HydrophobicContact CH2-CB 3.98Å; W77-P124 HydrophobicContact CH2-CG 4.03Å; W77-P124 HydrophobicContact CZ2-CB 3.99Å; W77-P124 HydrophobicContact CZ2-CG 4.41Å; W77-V130 HydrophobicContact CH2-CG2 4.36Å; W77-Y164 VanDerWaalsContact C-CZ 3.41Å; W77-Y164 WeakPolarHBondContact CA-O 3.31Å; W77-Y164 WeakPolarHBondContact CB-O 3.26Å; W77-Y164 WeakPolarHBondContact O-CE2 3.17Å; W77-Y164 PolarHBondContact O-OH 3.13Å; W77-Y164 VanDerWaalsContact O-OH 3.13Å; W77-A169 HydrophobicContact CB-CB 4.09Å; W77-L171 HydrophobicContact CB-CD1 3.74Å; W77-L171 HydrophobicContact CB-CD2 4.25Å; W77-L171 HydrophobicContact CD2-CD2 4.43Å; W77-L171 HydrophobicContact CE3-CD2 4.2Å; W77-L171 HydrophobicContact CG-CD1 3.94Å; W77-L171 HydrophobicContact CG-CD2 4.46Å
78	G	98.7	Very high	98.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	156.3	168.9	0	0	0	0	0	111.5	M102 V163 Y164	G78-M102 CarbonylContact C-O 3.42Å; G78-M102 WeakPolarHBondContact CA-O 3.12Å; G78-V163 CarbonylContact O-C 3.54Å; G78-V163 WeakPolarHBondContact O-CA 3.46Å; G78-Y164 VanDerWaalsContact CA-CZ 3.44Å; G78-Y164 VanDerWaalsContact N-CE2 3.3Å; G78-Y164 VanDerWaalsContact N-CZ 3.3Å; G78-Y164 PolarHBondContact N-O 3.11Å; G78-Y164 VanDerWaalsContact N-O 3.08Å; G78-Y164 PolarHBondContact O-N 2.94Å
79	I	98.9	Very high	98.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.7	-170.7	56.3	170.1	0	0	0	109.9	F69 W77 V101 M102 V130 I132 V162 V163 L171	F69-I79 HydrophobicContact CB-CD1 4.26Å; F69-I79 HydrophobicContact CB-CG2 4.08Å; F69-I79 HydrophobicContact CD1-CG2 3.74Å; F69-I79 HydrophobicContact CD2-CB 3.76Å; F69-I79 HydrophobicContact CD2-CD1 3.45Å; F69-I79 VanDerWaalsContact CD2-CD1 3.45Å; F69-I79 HydrophobicContact CD2-CG1 4.2Å; F69-I79 HydrophobicContact CD2-CG2 3.65Å; F69-I79 HydrophobicContact CE1-CG2 4.03Å; F69-I79 HydrophobicContact CE2-CB 3.69Å; F69-I79 HydrophobicContact CE2-CD1 4.04Å; F69-I79 HydrophobicContact CE2-CG1 4.41Å; F69-I79 HydrophobicContact CE2-CG2 3.89Å; F69-I79 HydrophobicContact CG-CB 4.2Å; F69-I79 HydrophobicContact CG-CD1 4.11Å; F69-I79 HydrophobicContact CG-CG2 3.54Å; F69-I79 HydrophobicContact CZ-CB 4.13Å; F69-I79 HydrophobicContact CZ-CG2 4.08Å; W77-I79 HydrophobicContact CE3-CG2 4.49Å; W77-I79 HydrophobicContact CZ3-CD1 4.38Å; W77-I79 HydrophobicContact CZ3-CG1 4.15Å; I79-V101 CarbonylContact O-C 3.5Å; I79-V101 VanDerWaalsContact O-CA 3.26Å; I79-V101 WeakPolarHBondContact O-CA 3.37Å; I79-M102 HydrophobicContact CD1-CE 4.17Å; I79-M102 HydrophobicContact CG1-CE 4.23Å; I79-M102 PolarHBondContact N-O 3.2Å; I79-M102 PolarHBondContact O-N 3.21Å; I79-V130 HydrophobicContact CD1-CB 3.6Å; I79-V130 HydrophobicContact CD1-CG1 3.52Å; I79-V130 HydrophobicContact CD1-CG2 4.44Å; I79-I132 HydrophobicContact CD1-CD1 3.98Å; I79-I132 HydrophobicContact CD1-CG1 4.01Å; I79-I132 HydrophobicContact CG1-CD1 4.32Å; I79-I132 HydrophobicContact CG1-CG1 4.48Å; I79-V162 CarbonylContact C-O 3.46Å; I79-V162 WeakPolarHBondContact CA-O 3.36Å; I79-V163 HydrophobicContact CG2-CB 4.18Å; I79-V163 HydrophobicContact CG2-CG2 3.86Å; I79-L171 HydrophobicContact CG2-CD2 3.76Å
80	G	98.7	Very high	98.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-130.2	174.7	0	0	0	0	0	111	P161 V162	G80-P161 WeakPolarHBondContact O-CA 3.36Å; G80-V162 PolarHBondContact N-O 3.25Å; G80-V162 PolarHBondContact O-N 2.76Å
81	V	98.7	Very high	98.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.4	-179.9	-64.2	0	0	0	0	112.3	L60 F67 L100 Y134 L139 I155 V159 Y160	L60-V81 HydrophobicContact CD1-CG1 3.6Å; F67-V81 HydrophobicContact CZ-CG1 4.08Å; V81-L100 HydrophobicContact CG2-CB 4.08Å; V81-L100 HydrophobicContact CG2-CD2 4.43Å; V81-L100 PolarHBondContact N-O 2.84Å; V81-L100 PolarHBondContact O-N 2.89Å; V81-Y134 HydrophobicContact CG1-CD2 3.96Å; V81-Y134 HydrophobicContact CG1-CE2 4.38Å; V81-Y134 HydrophobicContact CG1-CG 4.22Å; V81-Y134 HydrophobicContact CG2-CD2 4.15Å; V81-Y134 HydrophobicContact CG2-CE2 3.88Å; V81-L139 HydrophobicContact CG1-CD1 4.33Å; V81-L139 HydrophobicContact CG2-CD1 4.16Å; V81-I155 HydrophobicContact CG2-CD1 4.27Å; V81-I155 HydrophobicContact CG2-CG2 3.93Å; V81-V159 HydrophobicContact CB-CB 4.15Å; V81-V159 HydrophobicContact CB-CG2 4.25Å; V81-V159 HydrophobicContact CG1-CG2 4.5Å; V81-Y160 CarbonylContact C-O 3.57Å; V81-Y160 WeakPolarHBondContact CA-O 3.34Å
82	A	98.7	Very high	98.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	156.9	175.8	0	0	0	0	0	112.3	L55 V86 H98 V159 Y160 V162	L55-A82 HydrophobicContact CD2-CB 3.89Å; A82-V86 HydrophobicContact CB-CB 4.03Å; A82-V86 HydrophobicContact CB-CG1 3.87Å; A82-V86 HydrophobicContact CB-CG2 4.26Å; A82-H98 CarbonylContact C-O 3.28Å; A82-H98 WeakPolarHBondContact CA-O 3.33Å; A82-H98 VanDerWaalsContact CB-O 3.26Å; A82-H98 WeakPolarHBondContact CB-O 3.42Å; A82-V159 CarbonylContact O-C 3.43Å; A82-V159 WeakPolarHBondContact O-CA 3.39Å; A82-Y160 PolarHBondContact N-O 2.81Å; A82-Y160 PolarHBondContact O-N 3.4Å; A82-V162 HydrophobicContact CB-CB 3.83Å; A82-V162 HydrophobicContact CB-CG1 3.76Å; A82-V162 HydrophobicContact CB-CG2 4.16Å
83	T	98.5	Very high	98.2	Very high	12 Å²	12	38.3 Å²	38.3	7%	0.074	20%	0.201	C	C	.	.			trans	-84.2	160.3	168.7	71.6	0	0	0	0	110	K85 V86 H98 I155 R156 V159	T83-K85 PolarHBondContact O-N 3.48Å; T83-K85 PolarHBondContact OG1-N 3.28Å; T83-V86 WeakPolarHBondContact O-CB 3.42Å; T83-V86 VanDerWaalsContact O-CG1 3.22Å; T83-V86 WeakPolarHBondContact O-CG1 3.35Å; T83-V86 PolarHBondContact O-N 2.86Å; T83-H98 PolarHBondContact N-O 3.14Å; T83-H98 WeakPolarHBondContact OG1-CB 3.46Å; T83-H98 PolarHBondContact OG1-ND1 2.97Å; T83-I155 HydrophobicContact CG2-CD1 4.29Å; T83-I155 HydrophobicContact CG2-CG1 4.33Å; T83-R156 WeakPolarHBondContact CG2-O 3.39Å; T83-V159 HydrophobicContact CG2-CG1 4.16Å
84	Q	98	Very high	98.2	Very high	106 Å²	106	36.6 Å²	36.6	50%	0.495	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.7	174.1	-72.1	-177.7	-17.6	0	0	114.7	L55 V86 Y160	L55-Q84 HydrophobicContact CD1-CG 4.14Å; Q84-V86 VanDerWaalsContact C-N 3.27Å; Q84-V86 PolarHBondContact O-N 3.39Å; Q84-Y160 HydrophobicContact CG-CD2 4.15Å; Q84-Y160 HydrophobicContact CG-CE2 3.65Å; Q84-Y160 PolarHBondContact NE2-OH 2.82Å; Q84-Y160 VanDerWaalsContact NE2-OH 3.16Å
85	K	98.3	Very high	98.3	Very high	161 Å²	161	39.6 Å²	39.6	70%	0.7	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-5.4	177	-62.5	-178.5	179.5	-179.6	0	113.5	T83	T83-K85 PolarHBondContact O-N 3.48Å; T83-K85 PolarHBondContact OG1-N 3.28Å
86	V	98.4	Very high	98.3	Very high	11 Å²	11	40.9 Å²	40.9	7%	0.067	20%	0.195	C	C	.	.	S	Bend	trans	-63.6	139.8	-179.7	69.8	0	0	0	0	111.1	L55 A82 T83 Q84 L88 L93 H98	L55-V86 HydrophobicContact CD2-CG1 4.18Å; A82-V86 HydrophobicContact CB-CB 4.03Å; A82-V86 HydrophobicContact CB-CG1 3.87Å; A82-V86 HydrophobicContact CB-CG2 4.26Å; T83-V86 WeakPolarHBondContact O-CB 3.42Å; T83-V86 VanDerWaalsContact O-CG1 3.22Å; T83-V86 WeakPolarHBondContact O-CG1 3.35Å; T83-V86 PolarHBondContact O-N 2.86Å; Q84-V86 VanDerWaalsContact C-N 3.27Å; Q84-V86 PolarHBondContact O-N 3.39Å; V86-L88 HydrophobicContact CG1-CD2 3.52Å; V86-L88 HydrophobicContact CG1-CG 3.92Å; V86-L88 PolarHBondContact O-N 3.47Å; V86-L93 HydrophobicContact CG2-CD1 4.38Å; V86-L93 HydrophobicContact CG2-CD2 3.89Å; V86-H98 HydrophobicContact CB-CB 4.03Å
87	N	98.3	Very high	98.3	Very high	58 Å²	58	43.7 Å²	43.7	31%	0.31	21%	0.209	S	C	.	.			trans	-83.7	97.2	172.1	-171.1	-14.7	0	0	0	110.7	N89 Q90	N87-N89 PolarHBondContact O-N 2.91Å; N87-N89 VanDerWaalsContact O-N 3.16Å; N87-N89 WeakPolarHBondContact OD1-CB 3.34Å; N87-N89 PolarHBondContact OD1-N 3.4Å; N87-N89 VanDerWaalsContact OD1-N 3.09Å; N87-Q90 HydrophobicContact CB-CB 4.36Å; N87-Q90 HydrophobicContact CB-CG 4.48Å; N87-Q90 WeakPolarHBondContact ND2-CG 3.17Å; N87-Q90 PolarHBondContact ND2-NE2 2.92Å; N87-Q90 PolarHBondContact O-N 3.26Å
88	L	98.7	Very high	98.3	Very high	16 Å²	16	45.9 Å²	45.9	8%	0.084	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-8.8	-178.2	-61.9	172.9	0	0	0	114.3	H34 G52 G53 L55 V86 V162	H34-L88 HydrophobicContact CB-CD1 4.49Å; H34-L88 WeakPolarHBondContact O-CD1 3.21Å; G52-L88 CarbonylContact C-O 3.5Å; G52-L88 WeakPolarHBondContact CA-O 3.36Å; G53-L88 PolarHBondContact N-O 2.96Å; L55-L88 HydrophobicContact CD2-CD2 4.43Å; L55-L88 HydrophobicContact CG-CD1 4.37Å; L55-L88 HydrophobicContact CG-CD2 4.45Å; V86-L88 HydrophobicContact CG1-CD2 3.52Å; V86-L88 HydrophobicContact CG1-CG 3.92Å; V86-L88 PolarHBondContact O-N 3.47Å; L88-V162 HydrophobicContact CD2-CG2 4.13Å
89	N	98.4	Very high	98.3	Very high	85 Å²	85	45.9 Å²	45.9	46%	0.455	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-8.3	176.1	-60.3	-50.5	0	0	0	113	G36 T37 N87	G36-N89 WeakPolarHBondContact CA-OD1 3.26Å; T37-N89 PolarHBondContact N-OD1 2.87Å; T37-N89 PolarHBondContact OG1-OD1 2.86Å; N87-N89 PolarHBondContact O-N 2.91Å; N87-N89 VanDerWaalsContact O-N 3.16Å; N87-N89 WeakPolarHBondContact OD1-CB 3.34Å; N87-N89 PolarHBondContact OD1-N 3.4Å; N87-N89 VanDerWaalsContact OD1-N 3.09Å
90	Q	97.7	Very high	98.3	Very high	120 Å²	120	45.9 Å²	45.9	56%	0.561	22%	0.219	S	C	*	.	S	Bend	trans	-109.3	93.4	-175.8	-73.4	-176.6	-0.3	0	0	111.6	N87	N87-Q90 HydrophobicContact CB-CB 4.36Å; N87-Q90 HydrophobicContact CB-CG 4.48Å; N87-Q90 WeakPolarHBondContact ND2-CG 3.17Å; N87-Q90 PolarHBondContact ND2-NE2 2.92Å; N87-Q90 PolarHBondContact O-N 3.26Å
91	I	97.9	Very high	98.3	Very high	25 Å²	25	45.9 Å²	45.9	13%	0.128	22%	0.219	C	C	.	.	S	Bend	trans	-98.7	145.6	-178.4	-58.3	-46.2	0	0	0	111.4	I76 L93 R95 Y164 D166	I76-I91 HydrophobicContact CG2-CG2 4.09Å; I91-L93 HydrophobicContact CD1-CD2 3.91Å; I91-L93 HydrophobicContact CD1-CG 3.99Å; I91-R95 PolarHBondContact O-NH1 3.04Å; I91-Y164 HydrophobicContact CB-CD2 4.47Å; I91-Y164 VanDerWaalsContact CD1-CB 3.5Å; I91-Y164 HydrophobicContact CD1-CD1 4.49Å; I91-Y164 HydrophobicContact CD1-CD2 4.02Å; I91-Y164 HydrophobicContact CD1-CG 3.77Å; I91-Y164 HydrophobicContact CG1-CD2 4.37Å; I91-Y164 HydrophobicContact CG2-CD2 3.4Å; I91-Y164 VanDerWaalsContact CG2-CD2 3.4Å; I91-Y164 HydrophobicContact CG2-CE2 3.56Å; I91-Y164 HydrophobicContact CG2-CG 4.27Å; I91-D166 HydrophobicContact CG2-CB 4.06Å
92	P	98.3	Very high	98.3	Very high	29 Å²	29	45.9 Å²	45.9	19%	0.188	22%	0.219	C	C	.	.	S	Bend	cis	-66.5	150.4	-10.5	27.4	-40	0	0	0	114.8	R95 Y164	P92-R95 VanDerWaalsContact CD-CZ 3.5Å; P92-R95 VanDerWaalsContact CD-NH2 3.34Å; P92-Y164 HydrophobicContact CB-CE2 4.24Å; P92-Y164 WeakPolarHBondContact CB-OH 3.49Å
93	L	98.6	Very high	98.3	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.026	22%	0.224	C	C	.	.	S	Bend	trans	-70	174.3	166.9	-57.8	-173.4	0	0	0	111.4	V86 I91 R95 V101 R103 V162 Y164	V86-L93 HydrophobicContact CG2-CD1 4.38Å; V86-L93 HydrophobicContact CG2-CD2 3.89Å; I91-L93 HydrophobicContact CD1-CD2 3.91Å; I91-L93 HydrophobicContact CD1-CG 3.99Å; L93-R95 VanDerWaalsContact C-N 3.33Å; L93-V101 HydrophobicContact CB-CG1 4.19Å; L93-V101 HydrophobicContact CB-CG2 3.98Å; L93-R103 PolarHBondContact O-NE 3.09Å; L93-R103 VanDerWaalsContact O-NE 3.08Å; L93-R103 PolarHBondContact O-NH2 2.81Å; L93-V162 HydrophobicContact CD1-CG1 4.3Å; L93-V162 HydrophobicContact CD1-CG2 3.55Å; L93-Y164 HydrophobicContact CB-CD1 3.71Å; L93-Y164 HydrophobicContact CB-CE1 3.78Å; L93-Y164 HydrophobicContact CD1-CD1 3.73Å; L93-Y164 HydrophobicContact CD1-CG 4.41Å; L93-Y164 HydrophobicContact CG-CD1 3.48Å; L93-Y164 VanDerWaalsContact CG-CD1 3.48Å; L93-Y164 HydrophobicContact CG-CE1 4.07Å; L93-Y164 HydrophobicContact CG-CG 4.12Å
94	G	98.2	Very high	98.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.236	C	C	.	.			trans	82.9	7.9	-175.8	0	0	0	0	0	113.8	S99 H110 N111 N112	G94-S99 WeakPolarHBondContact CA-OG 3.4Å; G94-S99 PolarHBondContact N-OG 3.09Å; G94-H110 CarbonylContact O-C 3.55Å; G94-N111 PolarHBondContact O-N 2.67Å; G94-N112 WeakPolarHBondContact O-CA 3.22Å; G94-N112 PolarHBondContact O-N 3.45Å
95	R	97.8	Very high	98.2	Very high	125 Å²	125	47 Å²	47	47%	0.472	23%	0.226	S	C	.	.	S	Bend	trans	-82.4	-22.3	175.1	-71.4	-179.1	172.9	139.9	-9.4	113.5	I91 P92 L93 N112	I91-R95 PolarHBondContact O-NH1 3.04Å; P92-R95 VanDerWaalsContact CD-CZ 3.5Å; P92-R95 VanDerWaalsContact CD-NH2 3.34Å; L93-R95 VanDerWaalsContact C-N 3.33Å; R95-N112 PolarHBondContact O-N 3.39Å
96	D	96.9	Very high	98.2	Very high	46 Å²	46	39.3 Å²	39.3	25%	0.246	19%	0.192	C	C	.	.	S	Bend	trans	-116.8	178.7	-179.3	64.6	18	0	0	0	111.3	H98 S99 N111	D96-H98 PolarHBondContact O-N 2.97Å; D96-H98 WeakPolarHBondContact OD1-CA 3.41Å; D96-H98 WeakPolarHBondContact OD1-CB 3.46Å; D96-H98 PolarHBondContact OD1-N 3.23Å; D96-H98 IonicContact OD2-CD2 3.85Å; D96-S99 PolarHBondContact OD1-N 2.9Å; D96-S99 PolarHBondContact OD1-OG 3.16Å; D96-N111 VanDerWaalsContact O-CA 3.26Å; D96-N111 WeakPolarHBondContact O-CA 3.36Å; D96-N111 PolarHBondContact O-N 3.01Å
97	M	97.9	Very high	98.2	Very high	115 Å²	115	38.8 Å²	38.8	57%	0.567	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-0.9	175.6	66.5	-178.1	72	0	0	113.8	H110	M97-H110 PolarHBondContact O-CE1 3.03Å
98	H	98.5	Very high	98.2	Very high	49 Å²	49	36 Å²	36	23%	0.227	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-0.4	-173.2	-63.7	-49	0	0	0	113.2	A82 T83 V86 D96	A82-H98 CarbonylContact C-O 3.28Å; A82-H98 WeakPolarHBondContact CA-O 3.33Å; A82-H98 VanDerWaalsContact CB-O 3.26Å; A82-H98 WeakPolarHBondContact CB-O 3.42Å; T83-H98 PolarHBondContact N-O 3.14Å; T83-H98 WeakPolarHBondContact OG1-CB 3.46Å; T83-H98 PolarHBondContact OG1-ND1 2.97Å; V86-H98 HydrophobicContact CB-CB 4.03Å; D96-H98 PolarHBondContact O-N 2.97Å; D96-H98 WeakPolarHBondContact OD1-CA 3.41Å; D96-H98 WeakPolarHBondContact OD1-CB 3.46Å; D96-H98 PolarHBondContact OD1-N 3.23Å; D96-H98 IonicContact OD2-CD2 3.85Å
99	S	98.7	Very high	98.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	141.7	179.4	49.8	0	0	0	0	112.2	G94 D96 H110	G94-S99 WeakPolarHBondContact CA-OG 3.4Å; G94-S99 PolarHBondContact N-OG 3.09Å; D96-S99 PolarHBondContact OD1-N 2.9Å; D96-S99 PolarHBondContact OD1-OG 3.16Å; S99-H110 PolarHBondContact O-ND1 2.84Å
100	L	98.8	Very high	98.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	108.1	168.9	166.7	63.1	0	0	0	106.8	V81 Y109 H110 L139 A152 I155	V81-L100 HydrophobicContact CG2-CB 4.08Å; V81-L100 HydrophobicContact CG2-CD2 4.43Å; V81-L100 PolarHBondContact N-O 2.84Å; V81-L100 PolarHBondContact O-N 2.89Å; L100-Y109 WeakPolarHBondContact CA-O 3.36Å; L100-H110 HydrophobicContact CB-CB 4.26Å; L100-H110 HydrophobicContact CD1-CB 3.74Å; L100-L139 HydrophobicContact CD2-CB 3.93Å; L100-A152 HydrophobicContact CD1-CB 3.8Å; L100-A152 HydrophobicContact CD2-CB 4.44Å; L100-I155 HydrophobicContact CB-CB 4.05Å; L100-I155 HydrophobicContact CB-CD1 4.4Å; L100-I155 HydrophobicContact CB-CG2 4.09Å; L100-I155 HydrophobicContact CD2-CG2 4.08Å
101	V	98.8	Very high	98.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.4	-168.9	-64.3	0	0	0	0	111.8	I79 L93 R103 L108 Y109 V162 Y164	I79-V101 CarbonylContact O-C 3.5Å; I79-V101 VanDerWaalsContact O-CA 3.26Å; I79-V101 WeakPolarHBondContact O-CA 3.37Å; L93-V101 HydrophobicContact CB-CG1 4.19Å; L93-V101 HydrophobicContact CB-CG2 3.98Å; V101-R103 HydrophobicContact CG2-CG 4.49Å; V101-L108 CarbonylContact O-C 3.6Å; V101-L108 WeakPolarHBondContact O-CA 3.46Å; V101-Y109 PolarHBondContact N-O 2.96Å; V101-Y109 PolarHBondContact O-N 2.81Å; V101-V162 HydrophobicContact CG1-CG1 3.64Å; V101-Y164 HydrophobicContact CG2-CE1 4.2Å
102	M	98.6	Very high	98.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	130.8	159.6	-169.4	-170.6	73.7	0	0	108.8	W77 G78 I79 A107 L108 L118 P124 V130 V141	W77-M102 HydrophobicContact CH2-CE 3.56Å; W77-M102 HydrophobicContact CZ3-CE 3.58Å; G78-M102 CarbonylContact C-O 3.42Å; G78-M102 WeakPolarHBondContact CA-O 3.12Å; I79-M102 HydrophobicContact CD1-CE 4.17Å; I79-M102 HydrophobicContact CG1-CE 4.23Å; I79-M102 PolarHBondContact N-O 3.2Å; I79-M102 PolarHBondContact O-N 3.21Å; M102-A107 CarbonylContact C-O 3.49Å; M102-A107 WeakPolarHBondContact CA-O 3.47Å; M102-L108 HydrophobicContact CB-CD1 4.43Å; M102-L108 HydrophobicContact CB-CG 4.05Å; M102-L108 HydrophobicContact CG-CD1 4.09Å; M102-L108 HydrophobicContact CG-CG 4.24Å; M102-L118 HydrophobicContact SD-CD1 3.63Å; M102-L118 HydrophobicContact SD-CG 4.09Å; M102-P124 HydrophobicContact CE-CG 4.22Å; M102-V130 HydrophobicContact CE-CB 4.49Å; M102-V130 HydrophobicContact CE-CG1 3.71Å; M102-V130 HydrophobicContact CE-CG2 4.26Å; M102-V141 HydrophobicContact SD-CB 4.46Å; M102-V141 HydrophobicContact SD-CG1 3.67Å; M102-V141 HydrophobicContact SD-CG2 4.03Å
103	R	98.4	Very high	98.2	Very high	28 Å²	28	38.9 Å²	38.9	11%	0.106	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	168.4	176.2	-55.1	-171.4	172.9	157.4	-1.7	110.8	W77 L93 V101 D105 G106 A107 Y109 Y164	W77-R103 CarbonylContact O-C 3.59Å; L93-R103 PolarHBondContact O-NE 3.09Å; L93-R103 VanDerWaalsContact O-NE 3.08Å; L93-R103 PolarHBondContact O-NH2 2.81Å; V101-R103 HydrophobicContact CG2-CG 4.49Å; R103-D105 WeakPolarHBondContact CB-OD1 3.5Å; R103-D105 PolarHBondContact O-N 2.81Å; R103-D105 VanDerWaalsContact O-N 3.11Å; R103-G106 PolarHBondContact O-N 2.79Å; R103-A107 PolarHBondContact N-O 2.9Å; R103-Y109 HydrophobicContact CG-CD2 4.16Å; R103-Y164 WeakPolarHBondContact CG-OH 3.47Å
104	N	97.9	Very high	98.2	Very high	60 Å²	60	42.8 Å²	42.8	32%	0.321	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.4	180	64.2	-69.2	0	0	0	114.6	W77 G106	W77-N104 HydrophobicContact CD2-CB 3.89Å; W77-N104 HydrophobicContact CG-CB 3.95Å; W77-N104 HydrophobicContact CZ2-CB 4.08Å; W77-N104 PolarHBondContact O-N 2.94Å; N104-G106 PolarHBondContact O-N 2.96Å
105	D	97	Very high	98.2	Very high	53 Å²	53	46.5 Å²	46.5	28%	0.283	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	7.6	174.7	79.2	-35	0	0	0	113.5	R103 A107 R117 L123	R103-D105 WeakPolarHBondContact CB-OD1 3.5Å; R103-D105 PolarHBondContact O-N 2.81Å; R103-D105 VanDerWaalsContact O-N 3.11Å; D105-A107 VanDerWaalsContact C-N 3.26Å; D105-A107 PolarHBondContact O-N 2.74Å; D105-A107 VanDerWaalsContact OD1-CB 3.3Å; D105-A107 WeakPolarHBondContact OD1-CB 3.17Å; D105-A107 PolarHBondContact OD1-N 2.83Å; D105-A107 VanDerWaalsContact OD1-N 3.16Å; D105-R117 PolarHBondContact O-NH1 2.81Å; D105-R117 IonicContact OD2-CZ 3.58Å; D105-R117 IonicContact OD2-NH1 2.78Å; D105-R117 PolarHBondContact OD2-NH1 3.29Å; D105-R117 IonicContact OD2-NH2 3.57Å; D105-R117 PolarHBondContact OD2-NH2 3.01Å; D105-L123 WeakPolarHBondContact O-CD2 3.49Å
106	G	98	Very high	98.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	77.6	3.4	179.5	0	0	0	0	0	114.7	R103 N104 R117 L118	R103-G106 PolarHBondContact O-N 2.79Å; N104-G106 PolarHBondContact O-N 2.96Å; G106-R117 WeakPolarHBondContact O-CA 3.23Å; G106-L118 PolarHBondContact O-N 3.2Å
107	A	98.4	Very high	98.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	138.9	176.6	0	0	0	0	0	111.7	M102 R103 D105 Y109 E114	M102-A107 CarbonylContact C-O 3.49Å; M102-A107 WeakPolarHBondContact CA-O 3.47Å; R103-A107 PolarHBondContact N-O 2.9Å; D105-A107 VanDerWaalsContact C-N 3.26Å; D105-A107 PolarHBondContact O-N 2.74Å; D105-A107 VanDerWaalsContact OD1-CB 3.3Å; D105-A107 WeakPolarHBondContact OD1-CB 3.17Å; D105-A107 PolarHBondContact OD1-N 2.83Å; D105-A107 VanDerWaalsContact OD1-N 3.16Å; A107-Y109 HydrophobicContact CB-CD2 3.82Å; A107-Y109 HydrophobicContact CB-CE2 3.47Å; A107-Y109 VanDerWaalsContact CB-CE2 3.47Å; A107-E114 HydrophobicContact CB-CG 4.37Å
108	L	98.7	Very high	98.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	125.7	171.4	-72	84	0	0	0	109.7	V101 M102 E114 K115 N116 L139 V141 C150 A152	V101-L108 CarbonylContact O-C 3.6Å; V101-L108 WeakPolarHBondContact O-CA 3.46Å; M102-L108 HydrophobicContact CB-CD1 4.43Å; M102-L108 HydrophobicContact CB-CG 4.05Å; M102-L108 HydrophobicContact CG-CD1 4.09Å; M102-L108 HydrophobicContact CG-CG 4.24Å; L108-E114 CarbonylContact O-C 3.57Å; L108-E114 WeakPolarHBondContact O-CA 3.38Å; L108-K115 PolarHBondContact O-N 2.91Å; L108-N116 HydrophobicContact CB-CB 4.43Å; L108-N116 HydrophobicContact CD1-CB 4.34Å; L108-N116 PolarHBondContact N-O 2.92Å; L108-L139 HydrophobicContact CD2-CD2 3.62Å; L108-V141 HydrophobicContact CD1-CG2 4.28Å; L108-V141 HydrophobicContact CD2-CG2 3.96Å; L108-V141 HydrophobicContact CG-CG2 4.47Å; L108-C150 WeakPolarHBondContact CD1-SG 3.4Å; L108-A152 HydrophobicContact CB-CB 4.08Å; L108-A152 HydrophobicContact CD2-CB 3.5Å; L108-A152 HydrophobicContact CG-CB 4.44Å
109	Y	98.7	Very high	98.2	Very high	39 Å²	39	40.8 Å²	40.8	15%	0.153	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	138.8	-176.5	-86.8	-89.5	0	0	0	112.3	L100 V101 R103 A107 E113 E114	L100-Y109 WeakPolarHBondContact CA-O 3.36Å; V101-Y109 PolarHBondContact N-O 2.96Å; V101-Y109 PolarHBondContact O-N 2.81Å; R103-Y109 HydrophobicContact CG-CD2 4.16Å; A107-Y109 HydrophobicContact CB-CD2 3.82Å; A107-Y109 HydrophobicContact CB-CE2 3.47Å; A107-Y109 VanDerWaalsContact CB-CE2 3.47Å; Y109-E113 WeakPolarHBondContact CA-O 3.2Å; Y109-E113 VanDerWaalsContact CD1-C 3.5Å; Y109-E113 WeakPolarHBondContact CD1-O 3.38Å; Y109-E114 HydrophobicContact CE1-CB 4Å; Y109-E114 HydrophobicContact CE2-CB 4.36Å; Y109-E114 HydrophobicContact CE2-CG 4.47Å
110	H	98.6	Very high	97.8	Very high	16 Å²	16	45.3 Å²	45.3	7%	0.074	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	134.9	167.5	173.3	64.8	0	0	0	109.4	G94 M97 S99 L100 N112 E113 K115 G154	G94-H110 CarbonylContact O-C 3.55Å; M97-H110 PolarHBondContact O-CE1 3.03Å; S99-H110 PolarHBondContact O-ND1 2.84Å; L100-H110 HydrophobicContact CB-CB 4.26Å; L100-H110 HydrophobicContact CD1-CB 3.74Å; H110-N112 PolarHBondContact O-N 2.94Å; H110-E113 PolarHBondContact N-O 3.12Å; H110-E113 VanDerWaalsContact N-O 3.09Å; H110-E113 PolarHBondContact O-N 2.81Å; H110-K115 HydrophobicContact CB-CG 4.04Å; H110-G154 PolarHBondContact NE2-O 2.87Å
111	N	98.1	Very high	97.6	Very high	71 Å²	71	52.2 Å²	52.2	38%	0.38	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	40.6	-178.9	-164.9	52.2	0	0	0	113.4	G94 D96 E113	G94-N111 PolarHBondContact O-N 2.67Å; D96-N111 VanDerWaalsContact O-CA 3.26Å; D96-N111 WeakPolarHBondContact O-CA 3.36Å; D96-N111 PolarHBondContact O-N 3.01Å; N111-E113 PolarHBondContact O-N 2.68Å; N111-E113 VanDerWaalsContact O-N 3.13Å
112	N	97.7	Very high	97.4	Very high	103 Å²	103	53.2 Å²	53.2	55%	0.551	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	15	-177.3	-156.7	47.2	0	0	0	115.3	G94 R95 H110	G94-N112 WeakPolarHBondContact O-CA 3.22Å; G94-N112 PolarHBondContact O-N 3.45Å; R95-N112 PolarHBondContact O-N 3.39Å; H110-N112 PolarHBondContact O-N 2.94Å
113	E	98.3	Very high	97.4	Very high	106 Å²	106	56.8 Å²	56.8	50%	0.495	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.4	175.6	-67.4	175.7	178	0	0	110.1	Y109 H110 N111 K115	Y109-E113 WeakPolarHBondContact CA-O 3.2Å; Y109-E113 VanDerWaalsContact CD1-C 3.5Å; Y109-E113 WeakPolarHBondContact CD1-O 3.38Å; H110-E113 PolarHBondContact N-O 3.12Å; H110-E113 VanDerWaalsContact N-O 3.09Å; H110-E113 PolarHBondContact O-N 2.81Å; N111-E113 PolarHBondContact O-N 2.68Å; N111-E113 VanDerWaalsContact O-N 3.13Å; E113-K115 HydrophobicContact CB-CD 4.44Å; E113-K115 PolarHBondContact O-N 2.9Å; E113-K115 IonicContact OE2-NZ 2.78Å; E113-K115 PolarHBondContact OE2-NZ 2.84Å
114	E	98.4	Very high	97.4	Very high	88 Å²	88	56 Å²	56	41%	0.411	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	119	169.8	-173.7	172.4	146.6	0	0	108.6	A107 L108 Y109 R117	A107-E114 HydrophobicContact CB-CG 4.37Å; L108-E114 CarbonylContact O-C 3.57Å; L108-E114 WeakPolarHBondContact O-CA 3.38Å; Y109-E114 HydrophobicContact CE1-CB 4Å; Y109-E114 HydrophobicContact CE2-CB 4.36Å; Y109-E114 HydrophobicContact CE2-CG 4.47Å; E114-R117 IonicContact OE1-CZ 3.41Å; E114-R117 IonicContact OE1-NE 3.76Å; E114-R117 PolarHBondContact OE1-NE 3.29Å; E114-R117 IonicContact OE1-NH2 3.35Å; E114-R117 PolarHBondContact OE1-NH2 3.35Å; E114-R117 IonicContact OE2-CZ 2.72Å; E114-R117 IonicContact OE2-NE 3.9Å; E114-R117 IonicContact OE2-NH2 2.8Å; E114-R117 PolarHBondContact OE2-NH2 2.83Å
115	K	98.4	Very high	97.4	Very high	77 Å²	77	59.5 Å²	59.5	34%	0.335	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-33.8	-178.6	-60.6	-52.4	-172.8	-177.9	0	112.2	L108 H110 E113 A152	L108-K115 PolarHBondContact O-N 2.91Å; H110-K115 HydrophobicContact CB-CG 4.04Å; E113-K115 HydrophobicContact CB-CD 4.44Å; E113-K115 PolarHBondContact O-N 2.9Å; E113-K115 IonicContact OE2-NZ 2.78Å; E113-K115 PolarHBondContact OE2-NZ 2.84Å; K115-A152 HydrophobicContact CB-CB 3.9Å
116	N	98.2	Very high	97.4	Very high	53 Å²	53	62 Å²	62	28%	0.283	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	172.2	178.9	-149.3	-26.1	0	0	0	109.6	L108 C150 P151	L108-N116 HydrophobicContact CB-CB 4.43Å; L108-N116 HydrophobicContact CD1-CB 4.34Å; L108-N116 PolarHBondContact N-O 2.92Å; N116-C150 PolarHBondContact OD1-SG 2.85Å; N116-P151 PolarHBondContact ND2-O 2.99Å
117	R	98.2	Very high	97.4	Very high	98 Å²	98	64 Å²	64	37%	0.37	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	141.9	178.3	-172.3	179.2	-76.8	-90.8	1.7	111.6	D105 G106 E114 C150	D105-R117 PolarHBondContact O-NH1 2.81Å; D105-R117 IonicContact OD2-CZ 3.58Å; D105-R117 IonicContact OD2-NH1 2.78Å; D105-R117 PolarHBondContact OD2-NH1 3.29Å; D105-R117 IonicContact OD2-NH2 3.57Å; D105-R117 PolarHBondContact OD2-NH2 3.01Å; G106-R117 WeakPolarHBondContact O-CA 3.23Å; E114-R117 IonicContact OE1-CZ 3.41Å; E114-R117 IonicContact OE1-NE 3.76Å; E114-R117 PolarHBondContact OE1-NE 3.29Å; E114-R117 IonicContact OE1-NH2 3.35Å; E114-R117 PolarHBondContact OE1-NH2 3.35Å; E114-R117 IonicContact OE2-CZ 2.72Å; E114-R117 IonicContact OE2-NE 3.9Å; E114-R117 IonicContact OE2-NH2 2.8Å; E114-R117 PolarHBondContact OE2-NH2 2.83Å; R117-C150 PolarHBondContact O-SG 3.49Å; R117-C150 VanDerWaalsContact O-SG 3.41Å
118	L	97.8	Very high	97.4	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	35%	0.351	C	S	.	.			trans	-62.6	150	169.8	-65.3	-176.7	0	0	0	111.5	M102 G106 A120 P124 V141 M148 C150	M102-L118 HydrophobicContact SD-CD1 3.63Å; M102-L118 HydrophobicContact SD-CG 4.09Å; G106-L118 PolarHBondContact O-N 3.2Å; L118-A120 PolarHBondContact O-N 2.79Å; L118-P124 HydrophobicContact CD1-CG 4.08Å; L118-V141 HydrophobicContact CD2-CB 4.35Å; L118-V141 HydrophobicContact CD2-CG1 4.09Å; L118-M148 HydrophobicContact CD2-CB 3.48Å; L118-M148 VanDerWaalsContact CD2-CB 3.48Å; L118-M148 HydrophobicContact CD2-CE 4.31Å; L118-M148 HydrophobicContact CD2-CG 3.78Å; L118-C150 HydrophobicContact CD2-CB 3.94Å
119	P	95.7	Very high	97.5	Very high	60 Å²	60	66 Å²	66	39%	0.39	35%	0.353	S	S	.	.			trans	-54.1	139.9	169	-24.4	34.3	0	0	0	111.6	N121 S122 M148	P119-N121 WeakPolarHBondContact CB-OD1 3.15Å; P119-N121 PolarHBondContact O-N 3.26Å; P119-S122 WeakPolarHBondContact O-CA 3.34Å; P119-S122 WeakPolarHBondContact O-CB 3.43Å; P119-S122 PolarHBondContact O-N 3Å; P119-M148 HydrophobicContact CG-CE 4.23Å
120	A	91.8	Very high	97.5	Very high	94 Å²	94	64.2 Å²	64.2	78%	0.777	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-58.4	-26.2	-173.4	0	0	0	0	0	114.5	L118 S122	L118-A120 PolarHBondContact O-N 2.79Å; A120-S122 VanDerWaalsContact C-N 3.29Å
121	N	93.8	Very high	97.5	Very high	145 Å²	145	63.5 Å²	63.5	78%	0.775	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-87.9	8.2	176.7	67.9	-25.7	0	0	0	113.7	P119	P119-N121 WeakPolarHBondContact CB-OD1 3.15Å; P119-N121 PolarHBondContact O-N 3.26Å
122	S	96	Very high	97.5	Very high	22 Å²	22	60.1 Å²	60.1	15%	0.154	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-129.2	32.1	-175.2	-55.8	0	0	0	0	111.7	P119 A120 L143	P119-S122 WeakPolarHBondContact O-CA 3.34Å; P119-S122 WeakPolarHBondContact O-CB 3.43Å; P119-S122 PolarHBondContact O-N 3Å; A120-S122 VanDerWaalsContact C-N 3.29Å; S122-L143 WeakPolarHBondContact O-CD2 3.26Å
123	L	97.1	Very high	97.5	Very high	75 Å²	75	55.4 Å²	55.4	39%	0.393	30%	0.3	S	S	.	.			trans	-70.8	127	172.9	-65.5	-177.8	0	0	0	109.8	D105	D105-L123 WeakPolarHBondContact O-CD2 3.49Å
124	P	98	Very high	97.5	Very high	10 Å²	10	50.8 Å²	50.8	7%	0.065	28%	0.279	C	S	.	.			trans	-63.7	137.5	179.7	-23.2	34.9	0	0	0	112.7	I71 W77 M102 L118 V130 L143	I71-P124 HydrophobicContact CD1-CB 3.47Å; I71-P124 VanDerWaalsContact CD1-CB 3.47Å; W77-P124 HydrophobicContact CH2-CB 3.98Å; W77-P124 HydrophobicContact CH2-CG 4.03Å; W77-P124 HydrophobicContact CZ2-CB 3.99Å; W77-P124 HydrophobicContact CZ2-CG 4.41Å; M102-P124 HydrophobicContact CE-CG 4.22Å; L118-P124 HydrophobicContact CD1-CG 4.08Å; P124-V130 HydrophobicContact CB-CG2 3.74Å; P124-V130 HydrophobicContact CG-CG2 3.77Å; P124-L143 HydrophobicContact CB-CD1 4.02Å; P124-L143 HydrophobicContact CG-CD1 4.04Å
125	Q	97.8	Very high	97.4	Very high	134 Å²	134	49.1 Å²	49.1	63%	0.626	27%	0.272	S	S	*	.			trans	-119	176.3	-178.6	-60.1	-169.9	-12.5	0	0	112.2	G127 D128	Q125-G127 PolarHBondContact O-N 3.23Å; Q125-D128 PolarHBondContact N-OD2 2.92Å; Q125-D128 VanDerWaalsContact O-CB 3.3Å; Q125-D128 WeakPolarHBondContact O-CB 3.29Å; Q125-D128 PolarHBondContact O-N 2.8Å; Q125-D128 VanDerWaalsContact O-N 3.11Å
126	E	98.3	Very high	97	Very high	106 Å²	106	51.8 Å²	51.8	50%	0.495	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	133.9	171.8	-63.9	-169.8	167.5	0	0	111.4	S73 T74 D128	S73-E126 VanDerWaalsContact CA-OE1 3.31Å; S73-E126 WeakPolarHBondContact CA-OE1 3.39Å; S73-E126 PolarHBondContact OG-OE1 3.04Å; T74-E126 HydrophobicContact CG2-CB 4.48Å; T74-E126 HydrophobicContact CG2-CG 3.43Å; T74-E126 VanDerWaalsContact CG2-CG 3.43Å; T74-E126 PolarHBondContact N-OE1 2.81Å; T74-E126 PolarHBondContact OG1-OE1 2.8Å; E126-D128 VanDerWaalsContact C-N 3.3Å
127	G	98.4	Very high	96.8	Very high	43 Å²	43	52.7 Å²	52.7	44%	0.443	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-21.7	-176.3	0	0	0	0	0	114.3	I71 Q125	I71-G127 PolarHBondContact O-N 3.2Å; Q125-G127 PolarHBondContact O-N 3.23Å
128	D	98.6	Very high	96.7	Very high	34 Å²	34	52.9 Å²	52.9	18%	0.182	30%	0.298	C	S	.	.			trans	-69.1	153.2	179.5	-73.4	-26.3	0	0	0	112.4	K70 I71 Q125 E126 L143 N144	K70-D128 WeakPolarHBondContact CA-O 3.25Å; I71-D128 PolarHBondContact N-O 2.84Å; Q125-D128 PolarHBondContact N-OD2 2.92Å; Q125-D128 VanDerWaalsContact O-CB 3.3Å; Q125-D128 WeakPolarHBondContact O-CB 3.29Å; Q125-D128 PolarHBondContact O-N 2.8Å; Q125-D128 VanDerWaalsContact O-N 3.11Å; E126-D128 VanDerWaalsContact C-N 3.3Å; D128-L143 HydrophobicContact CB-CD1 3.88Å; D128-N144 WeakPolarHBondContact CA-OD1 3.4Å; D128-N144 PolarHBondContact OD1-ND2 3.15Å
129	V	98.8	Very high	96.8	Very high	7 Å²	7	52.6 Å²	52.6	4%	0.042	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.6	173.3	-176.8	0	0	0	0	109.1	E68 F69 K70 N144 Y179	E68-V129 HydrophobicContact CB-CG1 3.85Å; E68-V129 HydrophobicContact CG-CG1 4.12Å; F69-V129 CarbonylContact O-C 3.46Å; F69-V129 WeakPolarHBondContact O-CA 3.48Å; K70-V129 HydrophobicContact CB-CG2 4.14Å; K70-V129 HydrophobicContact CD-CG2 4.33Å; K70-V129 HydrophobicContact CG-CG2 4.16Å; V129-N144 PolarHBondContact N-OD1 3.08Å; V129-N144 PolarHBondContact O-N 2.83Å; V129-Y179 HydrophobicContact CG1-CD2 4.13Å; V129-Y179 HydrophobicContact CG2-CD2 3.96Å; V129-Y179 HydrophobicContact CG2-CG 4.02Å
130	V	98.8	Very high	96.9	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117	172.5	-168	0	0	0	0	109.3	E68 F69 I71 W77 I79 M102 P124 V141 Y142 L143	E68-V130 CarbonylContact C-O 3.58Å; E68-V130 WeakPolarHBondContact CA-O 3.36Å; F69-V130 PolarHBondContact N-O 3.49Å; F69-V130 PolarHBondContact O-N 2.86Å; I71-V130 HydrophobicContact CD1-CG2 4.21Å; W77-V130 HydrophobicContact CH2-CG2 4.36Å; I79-V130 HydrophobicContact CD1-CB 3.6Å; I79-V130 HydrophobicContact CD1-CG1 3.52Å; I79-V130 HydrophobicContact CD1-CG2 4.44Å; M102-V130 HydrophobicContact CE-CB 4.49Å; M102-V130 HydrophobicContact CE-CG1 3.71Å; M102-V130 HydrophobicContact CE-CG2 4.26Å; P124-V130 HydrophobicContact CB-CG2 3.74Å; P124-V130 HydrophobicContact CG-CG2 3.77Å; V130-V141 HydrophobicContact CG1-CG1 3.72Å; V130-Y142 CarbonylContact C-O 3.57Å; V130-Y142 WeakPolarHBondContact CA-O 3.48Å; V130-Y142 WeakPolarHBondContact CG1-O 3.49Å; V130-L143 HydrophobicContact CG2-CD1 4.29Å
131	G	98.7	Very high	97.2	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	142.1	175.2	0	0	0	0	0	111.4	Y142	G131-Y142 PolarHBondContact N-O 3.49Å; G131-Y142 PolarHBondContact O-N 3.48Å
132	I	98.7	Very high	97.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.9	176.2	-58.5	-63.3	0	0	0	108.5	Y66 F67 F69 I79 L139 V141	Y66-I132 WeakPolarHBondContact CA-O 3.31Å; Y66-I132 WeakPolarHBondContact CD2-O 3.33Å; F67-I132 HydrophobicContact CD2-CB 4.01Å; F67-I132 HydrophobicContact CD2-CG1 4.45Å; F67-I132 HydrophobicContact CE1-CB 4.25Å; F67-I132 HydrophobicContact CE1-CG2 3.97Å; F67-I132 HydrophobicContact CE2-CB 3.57Å; F67-I132 HydrophobicContact CE2-CG1 3.95Å; F67-I132 HydrophobicContact CE2-CG2 3.78Å; F67-I132 HydrophobicContact CZ-CB 3.7Å; F67-I132 HydrophobicContact CZ-CG1 4.45Å; F67-I132 HydrophobicContact CZ-CG2 3.41Å; F67-I132 VanDerWaalsContact CZ-CG2 3.41Å; F67-I132 PolarHBondContact N-O 3.23Å; F67-I132 VanDerWaalsContact N-O 3.14Å; F67-I132 PolarHBondContact O-N 3.46Å; F69-I132 HydrophobicContact CD2-CG1 4.42Å; F69-I132 HydrophobicContact CE2-CG1 4.06Å; I79-I132 HydrophobicContact CD1-CD1 3.98Å; I79-I132 HydrophobicContact CD1-CG1 4.01Å; I79-I132 HydrophobicContact CG1-CD1 4.32Å; I79-I132 HydrophobicContact CG1-CG1 4.48Å; I132-L139 HydrophobicContact CD1-CD2 4.37Å; I132-L139 HydrophobicContact CG2-CD1 3.66Å; I132-L139 HydrophobicContact CG2-CD2 4.4Å; I132-L139 HydrophobicContact CG2-CG 3.73Å; I132-V141 HydrophobicContact CD1-CG2 4.03Å
133	T	98.5	Very high	97.6	Very high	5 Å²	5	40 Å²	40	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	138.5	163.4	49.8	0	0	0	0	109.5	S65 Y66 L139 N140 Y142 P183 F186	S65-T133 WeakPolarHBondContact O-CA 3.43Å; Y66-T133 HydrophobicContact CD2-CG2 3.73Å; Y66-T133 HydrophobicContact CE2-CG2 4.3Å; T133-L139 CarbonylContact O-C 3.46Å; T133-L139 VanDerWaalsContact O-CA 3.3Å; T133-L139 WeakPolarHBondContact O-CA 3.33Å; T133-N140 PolarHBondContact N-O 2.83Å; T133-N140 PolarHBondContact O-N 2.81Å; T133-N140 WeakPolarHBondContact OG1-CB 3.44Å; T133-N140 PolarHBondContact OG1-O 2.81Å; T133-Y142 HydrophobicContact CG2-CD2 4.18Å; T133-Y142 HydrophobicContact CG2-CE2 3.49Å; T133-Y142 VanDerWaalsContact CG2-CE2 3.49Å; T133-P183 HydrophobicContact CG2-CG 3.79Å; T133-F186 VanDerWaalsContact CB-CE1 3.41Å; T133-F186 HydrophobicContact CG2-CB 4.46Å; T133-F186 HydrophobicContact CG2-CD1 3.56Å; T133-F186 HydrophobicContact CG2-CD2 4.12Å; T133-F186 HydrophobicContact CG2-CE1 3.74Å; T133-F186 HydrophobicContact CG2-CE2 4.24Å; T133-F186 HydrophobicContact CG2-CG 3.78Å; T133-F186 HydrophobicContact CG2-CZ 4.07Å
134	Y	98	Very high	97.6	Very high	9 Å²	9	39.8 Å²	39.8	4%	0.035	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120.9	170.1	-170.4	-100.7	0	0	0	110	L60 K64 S65 V81 H136 E138 L139 I155 V159	L60-Y134 HydrophobicContact CB-CD1 4.16Å; L60-Y134 HydrophobicContact CD1-CD1 3.63Å; L60-Y134 HydrophobicContact CD1-CE1 4.4Å; L60-Y134 HydrophobicContact CD1-CG 3.79Å; K64-Y134 CarbonylContact C-O 3.5Å; K64-Y134 WeakPolarHBondContact CA-O 3.32Å; K64-Y134 PolarHBondContact N-O 3.03Å; S65-Y134 PolarHBondContact N-O 2.77Å; S65-Y134 PolarHBondContact O-N 2.8Å; V81-Y134 HydrophobicContact CG1-CD2 3.96Å; V81-Y134 HydrophobicContact CG1-CE2 4.38Å; V81-Y134 HydrophobicContact CG1-CG 4.22Å; V81-Y134 HydrophobicContact CG2-CD2 4.15Å; V81-Y134 HydrophobicContact CG2-CE2 3.88Å; Y134-H136 PolarHBondContact OH-O 3.32Å; Y134-E138 WeakPolarHBondContact CA-O 3.38Å; Y134-L139 HydrophobicContact CD2-CB 4.07Å; Y134-I155 HydrophobicContact CE2-CG2 4.44Å; Y134-V159 HydrophobicContact CD1-CG2 4.33Å; Y134-V159 HydrophobicContact CE1-CG2 3.61Å; Y134-V159 HydrophobicContact CE2-CG2 4.46Å
135	D	96.5	Very high	97.6	Very high	53 Å²	53	41 Å²	41	28%	0.283	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	107	176	-167.7	16.3	0	0	0	110.2	K64 V137 E138 F186	K64-D135 WeakPolarHBondContact CE-OD2 3.46Å; K64-D135 HydrophobicContact CG-CB 4.14Å; K64-D135 VanDerWaalsContact CG-CG 3.43Å; K64-D135 WeakPolarHBondContact CG-OD1 3.18Å; K64-D135 WeakPolarHBondContact CG-OD2 3.48Å; K64-D135 PolarHBondContact N-OD1 2.94Å; D135-V137 PolarHBondContact O-N 2.74Å; D135-E138 PolarHBondContact N-O 2.87Å; D135-E138 PolarHBondContact O-N 2.78Å; D135-F186 HydrophobicContact CB-CE1 3.99Å; D135-F186 HydrophobicContact CB-CZ 4.08Å
136	H	89	Confident	97.7	Very high	132 Å²	132	41.5 Å²	41.5	61%	0.611	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	-64.6	178.4	-169.2	-82.1	0	0	0	115.3	Y134	Y134-H136 PolarHBondContact OH-O 3.32Å
137	V	94	Very high	97.7	Very high	73 Å²	73	38.5 Å²	38.5	44%	0.442	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-9.8	-179.4	-73.8	0	0	0	0	113.6	D135 S153	D135-V137 PolarHBondContact O-N 2.74Å; V137-S153 WeakPolarHBondContact O-CA 3.3Å; V137-S153 WeakPolarHBondContact O-CB 3.4Å
138	E	97.4	Very high	97.6	Very high	101 Å²	101	37.3 Å²	37.3	47%	0.472	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.5	-175.3	-172.3	175.1	94.2	0	0	110.9	Y134 D135 P151	Y134-E138 WeakPolarHBondContact CA-O 3.38Å; D135-E138 PolarHBondContact N-O 2.87Å; D135-E138 PolarHBondContact O-N 2.78Å; E138-P151 HydrophobicContact CG-CB 3.87Å
139	L	98.4	Very high	97.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	139.4	166.2	-179.1	147.2	0	0	0	108.6	V81 L100 L108 I132 T133 Y134 V141 P151 A152	V81-L139 HydrophobicContact CG1-CD1 4.33Å; V81-L139 HydrophobicContact CG2-CD1 4.16Å; L100-L139 HydrophobicContact CD2-CB 3.93Å; L108-L139 HydrophobicContact CD2-CD2 3.62Å; I132-L139 HydrophobicContact CD1-CD2 4.37Å; I132-L139 HydrophobicContact CG2-CD1 3.66Å; I132-L139 HydrophobicContact CG2-CD2 4.4Å; I132-L139 HydrophobicContact CG2-CG 3.73Å; T133-L139 CarbonylContact O-C 3.46Å; T133-L139 VanDerWaalsContact O-CA 3.3Å; T133-L139 WeakPolarHBondContact O-CA 3.33Å; Y134-L139 HydrophobicContact CD2-CB 4.07Å; L139-V141 HydrophobicContact CD2-CG2 4Å; L139-P151 CarbonylContact O-C 3.57Å; L139-P151 WeakPolarHBondContact O-CA 3.42Å; L139-A152 PolarHBondContact N-O 3.39Å; L139-A152 PolarHBondContact O-N 3.36Å
140	N	98.4	Very high	97.5	Very high	13 Å²	13	42.4 Å²	42.4	7%	0.07	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	152.5	168.8	179	55.8	0	0	0	111.3	T133 Y142 N147 C150 P151	T133-N140 PolarHBondContact N-O 2.83Å; T133-N140 PolarHBondContact O-N 2.81Å; T133-N140 WeakPolarHBondContact OG1-CB 3.44Å; T133-N140 PolarHBondContact OG1-O 2.81Å; N140-Y142 WeakPolarHBondContact ND2-CE2 3.48Å; N140-N147 PolarHBondContact ND2-ND2 3.05Å; N140-N147 PolarHBondContact ND2-OD1 3.28Å; N140-C150 PolarHBondContact OD1-N 3.16Å; N140-C150 PolarHBondContact OD1-O 3.04Å; N140-P151 HydrophobicContact CB-CB 4.45Å
141	V	98.7	Very high	97.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	139.5	-170	-177.5	0	0	0	0	111.7	M102 L108 L118 V130 I132 L139 M148	M102-V141 HydrophobicContact SD-CB 4.46Å; M102-V141 HydrophobicContact SD-CG1 3.67Å; M102-V141 HydrophobicContact SD-CG2 4.03Å; L108-V141 HydrophobicContact CD1-CG2 4.28Å; L108-V141 HydrophobicContact CD2-CG2 3.96Å; L108-V141 HydrophobicContact CG-CG2 4.47Å; L118-V141 HydrophobicContact CD2-CB 4.35Å; L118-V141 HydrophobicContact CD2-CG1 4.09Å; V130-V141 HydrophobicContact CG1-CG1 3.72Å; I132-V141 HydrophobicContact CD1-CG2 4.03Å; L139-V141 HydrophobicContact CD2-CG2 4Å; V141-M148 HydrophobicContact CG1-CG 4.49Å; V141-M148 WeakPolarHBondContact O-CB 3.21Å; V141-M148 PolarHBondContact O-N 3.03Å
142	Y	98.6	Very high	97.4	Very high	24 Å²	24	44.9 Å²	44.9	9%	0.094	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.6	171.7	-67.5	-107.4	0	0	0	109.3	V130 G131 T133 N140 K146 N147 P183	V130-Y142 CarbonylContact C-O 3.57Å; V130-Y142 WeakPolarHBondContact CA-O 3.48Å; V130-Y142 WeakPolarHBondContact CG1-O 3.49Å; G131-Y142 PolarHBondContact N-O 3.49Å; G131-Y142 PolarHBondContact O-N 3.48Å; T133-Y142 HydrophobicContact CG2-CD2 4.18Å; T133-Y142 HydrophobicContact CG2-CE2 3.49Å; T133-Y142 VanDerWaalsContact CG2-CE2 3.49Å; N140-Y142 WeakPolarHBondContact ND2-CE2 3.48Å; Y142-K146 CarbonylContact C-O 3.58Å; Y142-K146 WeakPolarHBondContact CA-O 3.33Å; Y142-N147 VanDerWaalsContact CD1-CA 3.44Å; Y142-N147 HydrophobicContact CD1-CB 3.88Å; Y142-N147 HydrophobicContact CE1-CB 3.44Å; Y142-N147 VanDerWaalsContact CE1-CB 3.44Å; Y142-N147 PolarHBondContact OH-ND2 3.22Å; Y142-P183 HydrophobicContact CD1-CG 4.27Å; Y142-P183 HydrophobicContact CE1-CB 4.38Å; Y142-P183 HydrophobicContact CE1-CG 3.48Å; Y142-P183 VanDerWaalsContact CE1-CG 3.48Å; Y142-P183 HydrophobicContact CE2-CG 3.84Å; Y142-P183 WeakPolarHBondContact OH-CG 3.33Å
143	L	98.6	Very high	97.4	Very high	19 Å²	19	47.8 Å²	47.8	10%	0.099	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	120.7	172.6	178.9	60	0	0	0	108.9	S122 P124 D128 V130 G145 K146 M148	S122-L143 WeakPolarHBondContact O-CD2 3.26Å; P124-L143 HydrophobicContact CB-CD1 4.02Å; P124-L143 HydrophobicContact CG-CD1 4.04Å; D128-L143 HydrophobicContact CB-CD1 3.88Å; V130-L143 HydrophobicContact CG2-CD1 4.29Å; L143-G145 PolarHBondContact O-N 2.85Å; L143-K146 PolarHBondContact N-O 3.3Å; L143-K146 WeakPolarHBondContact O-CB 3.37Å; L143-K146 PolarHBondContact O-N 2.81Å; L143-M148 HydrophobicContact CB-CG 3.9Å; L143-M148 HydrophobicContact CB-SD 3.71Å
144	N	98.4	Very high	97.3	Very high	71 Å²	71	49.2 Å²	49.2	38%	0.38	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	44	-177.9	-61.5	-33.5	0	0	0	112.4	D128 V129 K146 H180	D128-N144 WeakPolarHBondContact CA-OD1 3.4Å; D128-N144 PolarHBondContact OD1-ND2 3.15Å; V129-N144 PolarHBondContact N-OD1 3.08Å; V129-N144 PolarHBondContact O-N 2.83Å; N144-K146 PolarHBondContact O-N 2.94Å; N144-H180 WeakPolarHBondContact CA-NE2 3.48Å; N144-H180 PolarHBondContact O-CE1 3.37Å
145	G	98.1	Very high	97.3	Very high	35 Å²	35	48.9 Å²	48.9	36%	0.361	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	-7.8	-178.2	0	0	0	0	0	115.6	L143 H180	L143-G145 PolarHBondContact O-N 2.85Å; G145-H180 PolarHBondContact N-CD2 2.85Å
146	K	98.1	Very high	97.3	Very high	144 Å²	144	56.7 Å²	56.7	63%	0.626	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	129.4	177.2	-176.1	-175.9	173.9	-173.4	0	110.7	Y142 L143 N144 M148	Y142-K146 CarbonylContact C-O 3.58Å; Y142-K146 WeakPolarHBondContact CA-O 3.33Å; L143-K146 PolarHBondContact N-O 3.3Å; L143-K146 WeakPolarHBondContact O-CB 3.37Å; L143-K146 PolarHBondContact O-N 2.81Å; N144-K146 PolarHBondContact O-N 2.94Å; K146-M148 PolarHBondContact O-N 3.41Å
147	N	98.1	Very high	97.6	Very high	43 Å²	43	53.6 Å²	53.6	23%	0.23	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	126.9	172.6	-165.9	-22	0	0	0	110.2	N140 Y142 H149	N140-N147 PolarHBondContact ND2-ND2 3.05Å; N140-N147 PolarHBondContact ND2-OD1 3.28Å; Y142-N147 VanDerWaalsContact CD1-CA 3.44Å; Y142-N147 HydrophobicContact CD1-CB 3.88Å; Y142-N147 HydrophobicContact CE1-CB 3.44Å; Y142-N147 VanDerWaalsContact CE1-CB 3.44Å; Y142-N147 PolarHBondContact OH-ND2 3.22Å; N147-H149 VanDerWaalsContact C-N 3.35Å; N147-H149 WeakPolarHBondContact OD1-CA 3.21Å; N147-H149 PolarHBondContact OD1-N 3.09Å
148	M	98	Very high	97.7	Very high	18 Å²	18	53.6 Å²	53.6	9%	0.089	30%	0.296	C	S	.	.			trans	-89.8	-3.9	178.7	-60.4	-51.8	-59.6	0	0	113.3	L118 P119 V141 L143 K146 C150	L118-M148 HydrophobicContact CD2-CB 3.48Å; L118-M148 VanDerWaalsContact CD2-CB 3.48Å; L118-M148 HydrophobicContact CD2-CE 4.31Å; L118-M148 HydrophobicContact CD2-CG 3.78Å; P119-M148 HydrophobicContact CG-CE 4.23Å; V141-M148 HydrophobicContact CG1-CG 4.49Å; V141-M148 WeakPolarHBondContact O-CB 3.21Å; V141-M148 PolarHBondContact O-N 3.03Å; L143-M148 HydrophobicContact CB-CG 3.9Å; L143-M148 HydrophobicContact CB-SD 3.71Å; K146-M148 PolarHBondContact O-N 3.41Å; M148-C150 HydrophobicContact CB-CB 4.27Å; M148-C150 PolarHBondContact O-N 2.81Å
149	H	96.9	Very high	97.7	Very high	147 Å²	147	48.9 Å²	48.9	68%	0.681	28%	0.275	S	S	*	.			trans	50.7	44.7	-177.8	-59.9	-72.7	0	0	0	111.8	N147 P151	N147-H149 VanDerWaalsContact C-N 3.35Å; N147-H149 WeakPolarHBondContact OD1-CA 3.21Å; N147-H149 PolarHBondContact OD1-N 3.09Å; H149-P151 VanDerWaalsContact O-CD 3.25Å; H149-P151 WeakPolarHBondContact O-CD 3.02Å
150	C	96.7	Very high	97.7	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.007	28%	0.28	C	S	.	.			trans	-122	65.6	-173.7	-160.6	0	0	0	0	110	L108 N116 R117 L118 N140 M148	L108-C150 WeakPolarHBondContact CD1-SG 3.4Å; N116-C150 PolarHBondContact OD1-SG 2.85Å; R117-C150 PolarHBondContact O-SG 3.49Å; R117-C150 VanDerWaalsContact O-SG 3.41Å; L118-C150 HydrophobicContact CD2-CB 3.94Å; N140-C150 PolarHBondContact OD1-N 3.16Å; N140-C150 PolarHBondContact OD1-O 3.04Å; M148-C150 HydrophobicContact CB-CB 4.27Å; M148-C150 PolarHBondContact O-N 2.81Å
151	P	97.9	Very high	97.7	Very high	47 Å²	47	49.8 Å²	49.8	31%	0.305	28%	0.277	S	S	.	.			trans	-74.1	150.2	-179.9	31.4	-35.9	0	0	0	111.3	N116 E138 L139 N140 H149	N116-P151 PolarHBondContact ND2-O 2.99Å; E138-P151 HydrophobicContact CG-CB 3.87Å; L139-P151 CarbonylContact O-C 3.57Å; L139-P151 WeakPolarHBondContact O-CA 3.42Å; N140-P151 HydrophobicContact CB-CB 4.45Å; H149-P151 VanDerWaalsContact O-CD 3.25Å; H149-P151 WeakPolarHBondContact O-CD 3.02Å
152	A	98.4	Very high	97.7	Very high	7 Å²	7	49.8 Å²	49.8	6%	0.058	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	151.5	169.7	0	0	0	0	0	110.9	L100 L108 K115 L139	L100-A152 HydrophobicContact CD1-CB 3.8Å; L100-A152 HydrophobicContact CD2-CB 4.44Å; L108-A152 HydrophobicContact CB-CB 4.08Å; L108-A152 HydrophobicContact CD2-CB 3.5Å; L108-A152 HydrophobicContact CG-CB 4.44Å; K115-A152 HydrophobicContact CB-CB 3.9Å; L139-A152 PolarHBondContact N-O 3.39Å; L139-A152 PolarHBondContact O-N 3.36Å
153	S	98	Very high	97.7	Very high	61 Å²	61	48.7 Å²	48.7	43%	0.427	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	177.2	-179.1	64	0	0	0	0	110.8	V137	V137-S153 WeakPolarHBondContact O-CA 3.3Å; V137-S153 WeakPolarHBondContact O-CB 3.4Å
154	G	97	Very high	97.7	Very high	35 Å²	35	47.8 Å²	47.8	36%	0.361	27%	0.269	S	S	.	.			trans	130.9	-28.3	173.3	0	0	0	0	0	114	H110	H110-G154 PolarHBondContact NE2-O 2.87Å
155	I	98	Very high	97.8	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.015	25%	0.25	C	S	.	.			trans	-64.4	145.1	175	-165.1	167.4	0	0	0	111.1	V81 T83 L100 Y134 V159	V81-I155 HydrophobicContact CG2-CD1 4.27Å; V81-I155 HydrophobicContact CG2-CG2 3.93Å; T83-I155 HydrophobicContact CG2-CD1 4.29Å; T83-I155 HydrophobicContact CG2-CG1 4.33Å; L100-I155 HydrophobicContact CB-CB 4.05Å; L100-I155 HydrophobicContact CB-CD1 4.4Å; L100-I155 HydrophobicContact CB-CG2 4.09Å; L100-I155 HydrophobicContact CD2-CG2 4.08Å; Y134-I155 HydrophobicContact CE2-CG2 4.44Å; I155-V159 HydrophobicContact CD1-CG1 3.65Å; I155-V159 HydrophobicContact CG1-CG1 3.81Å; I155-V159 HydrophobicContact CG2-CG1 4.13Å
156	R	96.1	Very high	97.8	Very high	217 Å²	217	44.9 Å²	44.9	82%	0.819	25%	0.245	S	C	*	.			trans	-132.9	155.8	-176.1	-61.8	-176.5	-178.8	-127.5	0.7	111.8	T83	T83-R156 WeakPolarHBondContact CG2-O 3.39Å
157	G	95.6	Very high	97.7	Very high	66 Å²	66	43 Å²	43	68%	0.68	24%	0.241	S	C	*	.	S	Bend	trans	88.4	-169.5	179.7	0	0	0	0	0	112.4	V159	G157-V159 PolarHBondContact O-N 2.82Å
158	T	96	Very high	97.7	Very high	73 Å²	73	45.5 Å²	45.5	45%	0.448	26%	0.262	S	S	.	.	S	Bend	trans	-69.3	119.5	175.6	-56.2	0	0	0	0	109.9	P59 H61 Y160	P59-T158 HydrophobicContact CB-CG2 3.51Å; P59-T158 HydrophobicContact CG-CG2 4.48Å; H61-T158 WeakPolarHBondContact NE2-CG2 3.43Å; T158-Y160 HydrophobicContact CG2-CE2 3.85Å
159	V	97.8	Very high	97.7	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.018	26%	0.258	C	S	.	.			trans	-113.2	154.2	180	-61.4	0	0	0	0	111.5	P59 L60 V81 A82 T83 Y134 I155 G157	P59-V159 WeakPolarHBondContact CA-O 3.42Å; L60-V159 HydrophobicContact CB-CG2 4.21Å; L60-V159 HydrophobicContact CD1-CG2 4.23Å; L60-V159 HydrophobicContact CG-CG2 4.49Å; L60-V159 PolarHBondContact N-O 2.96Å; V81-V159 HydrophobicContact CB-CB 4.15Å; V81-V159 HydrophobicContact CB-CG2 4.25Å; V81-V159 HydrophobicContact CG1-CG2 4.5Å; A82-V159 CarbonylContact O-C 3.43Å; A82-V159 WeakPolarHBondContact O-CA 3.39Å; T83-V159 HydrophobicContact CG2-CG1 4.16Å; Y134-V159 HydrophobicContact CD1-CG2 4.33Å; Y134-V159 HydrophobicContact CE1-CG2 3.61Å; Y134-V159 HydrophobicContact CE2-CG2 4.46Å; I155-V159 HydrophobicContact CD1-CG1 3.65Å; I155-V159 HydrophobicContact CG1-CG1 3.81Å; I155-V159 HydrophobicContact CG2-CG1 4.13Å; G157-V159 PolarHBondContact O-N 2.82Å
160	Y	98.3	Very high	97.8	Very high	30 Å²	30	40.1 Å²	40.1	12%	0.118	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.9	179.1	-64.2	-105.6	0	0	0	107.6	A56 A58 P59 V81 A82 Q84 T158 V162	A56-Y160 WeakPolarHBondContact O-CD1 3.29Å; A58-Y160 VanDerWaalsContact C-CD1 3.43Å; A58-Y160 WeakPolarHBondContact O-CD1 3.36Å; P59-Y160 HydrophobicContact CB-CD1 4.13Å; P59-Y160 HydrophobicContact CB-CE1 3.66Å; P59-Y160 HydrophobicContact CB-CE2 4.04Å; P59-Y160 HydrophobicContact CG-CE1 4.14Å; P59-Y160 VanDerWaalsContact N-CE1 3.29Å; V81-Y160 CarbonylContact C-O 3.57Å; V81-Y160 WeakPolarHBondContact CA-O 3.34Å; A82-Y160 PolarHBondContact N-O 2.81Å; A82-Y160 PolarHBondContact O-N 3.4Å; Q84-Y160 HydrophobicContact CG-CD2 4.15Å; Q84-Y160 HydrophobicContact CG-CE2 3.65Å; Q84-Y160 PolarHBondContact NE2-OH 2.82Å; Q84-Y160 VanDerWaalsContact NE2-OH 3.16Å; T158-Y160 HydrophobicContact CG2-CE2 3.85Å; Y160-V162 PolarHBondContact O-N 3.08Å
161	P	98.5	Very high	97.9	Very high	1 Å²	1	40 Å²	40	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	137.8	161.9	-19.6	28.8	0	0	0	110.1	L55 A56 L60 F67 G80 F175 I189	L55-P161 CarbonylContact C-O 3.6Å; L55-P161 WeakPolarHBondContact CA-O 3.33Å; A56-P161 HydrophobicContact CB-CB 3.84Å; A56-P161 HydrophobicContact CB-CG 3.8Å; A56-P161 PolarHBondContact N-O 2.8Å; L60-P161 HydrophobicContact CD2-CG 3.89Å; L60-P161 HydrophobicContact CG-CG 4.41Å; F67-P161 HydrophobicContact CD1-CB 4.47Å; F67-P161 HydrophobicContact CD1-CG 4.13Å; F67-P161 HydrophobicContact CD2-CB 4.02Å; F67-P161 HydrophobicContact CE1-CB 4.26Å; F67-P161 HydrophobicContact CE1-CG 4.05Å; F67-P161 HydrophobicContact CE2-CB 3.76Å; F67-P161 HydrophobicContact CE2-CG 4.41Å; F67-P161 HydrophobicContact CG-CB 4.36Å; F67-P161 HydrophobicContact CG-CG 4.37Å; F67-P161 HydrophobicContact CZ-CB 3.9Å; F67-P161 HydrophobicContact CZ-CG 4.18Å; G80-P161 WeakPolarHBondContact O-CA 3.36Å; P161-F175 HydrophobicContact CB-CE1 3.77Å; P161-F175 HydrophobicContact CG-CD1 4.42Å; P161-F175 HydrophobicContact CG-CE1 4.05Å; P161-I189 HydrophobicContact CG-CD1 3.34Å
162	V	98.9	Very high	97.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	144.7	175.4	69.4	0	0	0	0	109.8	C54 L55 I79 G80 A82 L88 L93 V101 Y160	C54-V162 WeakPolarHBondContact O-CA 3.27Å; L55-V162 HydrophobicContact CD2-CB 3.82Å; L55-V162 HydrophobicContact CD2-CG2 3.78Å; I79-V162 CarbonylContact C-O 3.46Å; I79-V162 WeakPolarHBondContact CA-O 3.36Å; G80-V162 PolarHBondContact N-O 3.25Å; G80-V162 PolarHBondContact O-N 2.76Å; A82-V162 HydrophobicContact CB-CB 3.83Å; A82-V162 HydrophobicContact CB-CG1 3.76Å; A82-V162 HydrophobicContact CB-CG2 4.16Å; L88-V162 HydrophobicContact CD2-CG2 4.13Å; L93-V162 HydrophobicContact CD1-CG1 4.3Å; L93-V162 HydrophobicContact CD1-CG2 3.55Å; V101-V162 HydrophobicContact CG1-CG1 3.64Å; Y160-V162 PolarHBondContact O-N 3.08Å
163	V	98.9	Very high	97.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	143	169.1	55.4	0	0	0	0	108.5	L30 I48 G53 C54 F69 G78 I79 L171	L30-V163 HydrophobicContact CD1-CG1 4.49Å; L30-V163 HydrophobicContact CD2-CG1 3.62Å; I48-V163 HydrophobicContact CD1-CG1 3.93Å; I48-V163 HydrophobicContact CG2-CG1 3.97Å; I48-V163 HydrophobicContact CG2-CG2 3.8Å; G53-V163 CarbonylContact C-O 3.5Å; G53-V163 WeakPolarHBondContact CA-O 3.47Å; C54-V163 PolarHBondContact N-O 2.89Å; C54-V163 PolarHBondContact O-N 2.93Å; C54-V163 VanDerWaalsContact O-N 3.09Å; F69-V163 HydrophobicContact CD1-CB 4.22Å; F69-V163 HydrophobicContact CD1-CG2 4.28Å; F69-V163 HydrophobicContact CE1-CB 3.78Å; F69-V163 HydrophobicContact CE1-CG1 4.31Å; F69-V163 HydrophobicContact CE1-CG2 4.34Å; G78-V163 CarbonylContact O-C 3.54Å; G78-V163 WeakPolarHBondContact O-CA 3.46Å; I79-V163 HydrophobicContact CG2-CB 4.18Å; I79-V163 HydrophobicContact CG2-CG2 3.86Å; V163-L171 HydrophobicContact CG2-CB 4.3Å; V163-L171 HydrophobicContact CG2-CD2 3.69Å
164	Y	98.9	Very high	97.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	154.7	167.1	73.1	-100.9	0	0	0	111.6	G52 I76 W77 G78 I91 P92 L93 V101 R103	G52-Y164 CarbonylContact O-C 3.59Å; G52-Y164 VanDerWaalsContact O-CA 3.23Å; G52-Y164 WeakPolarHBondContact O-CA 3.38Å; G52-Y164 WeakPolarHBondContact O-CB 3.31Å; I76-Y164 HydrophobicContact CG2-CE2 4Å; W77-Y164 VanDerWaalsContact C-CZ 3.41Å; W77-Y164 WeakPolarHBondContact CA-O 3.31Å; W77-Y164 WeakPolarHBondContact CB-O 3.26Å; W77-Y164 WeakPolarHBondContact O-CE2 3.17Å; W77-Y164 PolarHBondContact O-OH 3.13Å; W77-Y164 VanDerWaalsContact O-OH 3.13Å; G78-Y164 VanDerWaalsContact CA-CZ 3.44Å; G78-Y164 VanDerWaalsContact N-CE2 3.3Å; G78-Y164 VanDerWaalsContact N-CZ 3.3Å; G78-Y164 PolarHBondContact N-O 3.11Å; G78-Y164 VanDerWaalsContact N-O 3.08Å; G78-Y164 PolarHBondContact O-N 2.94Å; I91-Y164 HydrophobicContact CB-CD2 4.47Å; I91-Y164 VanDerWaalsContact CD1-CB 3.5Å; I91-Y164 HydrophobicContact CD1-CD1 4.49Å; I91-Y164 HydrophobicContact CD1-CD2 4.02Å; I91-Y164 HydrophobicContact CD1-CG 3.77Å; I91-Y164 HydrophobicContact CG1-CD2 4.37Å; I91-Y164 HydrophobicContact CG2-CD2 3.4Å; I91-Y164 VanDerWaalsContact CG2-CD2 3.4Å; I91-Y164 HydrophobicContact CG2-CE2 3.56Å; I91-Y164 HydrophobicContact CG2-CG 4.27Å; P92-Y164 HydrophobicContact CB-CE2 4.24Å; P92-Y164 WeakPolarHBondContact CB-OH 3.49Å; L93-Y164 HydrophobicContact CB-CD1 3.71Å; L93-Y164 HydrophobicContact CB-CE1 3.78Å; L93-Y164 HydrophobicContact CD1-CD1 3.73Å; L93-Y164 HydrophobicContact CD1-CG 4.41Å; L93-Y164 HydrophobicContact CG-CD1 3.48Å; L93-Y164 VanDerWaalsContact CG-CD1 3.48Å; L93-Y164 HydrophobicContact CG-CE1 4.07Å; L93-Y164 HydrophobicContact CG-CG 4.12Å; V101-Y164 HydrophobicContact CG2-CE1 4.2Å; R103-Y164 WeakPolarHBondContact CG-OH 3.47Å
165	V	98.8	Very high	97.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.8	178.9	-67.6	0	0	0	0	109.8	I48 G50 T51 G52 I76 A169 L171	I48-V165 HydrophobicContact CD1-CG2 4Å; I48-V165 HydrophobicContact CG1-CG1 4.42Å; I48-V165 HydrophobicContact CG1-CG2 3.72Å; I48-V165 HydrophobicContact CG2-CG1 3.9Å; G50-V165 WeakPolarHBondContact O-CG2 3.42Å; T51-V165 CarbonylContact C-O 3.53Å; T51-V165 WeakPolarHBondContact CA-O 3.2Å; G52-V165 PolarHBondContact N-O 3.31Å; G52-V165 PolarHBondContact O-N 3.31Å; I76-V165 CarbonylContact O-C 3.53Å; I76-V165 WeakPolarHBondContact O-CA 3.46Å; V165-A169 HydrophobicContact CB-CB 4.05Å; V165-A169 HydrophobicContact CG1-CB 4.08Å; V165-L171 HydrophobicContact CG1-CD1 3.95Å
166	D	98.6	Very high	97.8	Very high	44 Å²	44	35.3 Å²	35.3	24%	0.235	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	170.5	171.1	-172.7	26.8	0	0	0	108.3	T51 I76 I91 S168 A169	T51-D166 HydrophobicContact CG2-CB 4.22Å; T51-D166 VanDerWaalsContact CG2-OD1 3.27Å; T51-D166 WeakPolarHBondContact CG2-OD1 3.43Å; T51-D166 PolarHBondContact OG1-OD1 3.15Å; I76-D166 HydrophobicContact CB-CB 3.93Å; I76-D166 HydrophobicContact CG2-CB 4.07Å; I76-D166 PolarHBondContact N-O 2.77Å; I76-D166 PolarHBondContact O-N 2.9Å; I91-D166 HydrophobicContact CG2-CB 4.06Å; D166-S168 PolarHBondContact O-N 2.8Å; D166-A169 WeakPolarHBondContact O-CB 3.41Å; D166-A169 PolarHBondContact O-N 2.96Å; D166-A169 VanDerWaalsContact O-N 3.15Å
167	D	97.3	Very high	97.7	Very high	105 Å²	105	32.7 Å²	32.7	56%	0.561	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	53.6	179.7	-166	26.9	0	0	0	113	G75 I76 A169	G75-D167 WeakPolarHBondContact CA-O 3.42Å; I76-D167 HydrophobicContact CB-CB 4.33Å; I76-D167 HydrophobicContact CD1-CB 4.07Å; I76-D167 HydrophobicContact CG1-CB 4.02Å; D167-A169 PolarHBondContact O-N 3.33Å; D167-A169 VanDerWaalsContact O-N 3.15Å
168	S	96.6	Very high	97.8	Very high	96 Å²	96	31.6 Å²	31.6	67%	0.671	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.7	8.5	178.3	-48.5	0	0	0	0	116.8	D166	D166-S168 PolarHBondContact O-N 2.8Å
169	A	98.6	Very high	97.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.			trans	-60.4	141.2	176.5	0	0	0	0	0	112.5	S73 I76 W77 V165 D166 D167 L171	S73-A169 WeakPolarHBondContact O-CA 3.49Å; I76-A169 VanDerWaalsContact O-CB 3.29Å; I76-A169 WeakPolarHBondContact O-CB 3.38Å; W77-A169 HydrophobicContact CB-CB 4.09Å; V165-A169 HydrophobicContact CB-CB 4.05Å; V165-A169 HydrophobicContact CG1-CB 4.08Å; D166-A169 WeakPolarHBondContact O-CB 3.41Å; D166-A169 PolarHBondContact O-N 2.96Å; D166-A169 VanDerWaalsContact O-N 3.15Å; D167-A169 PolarHBondContact O-N 3.33Å; D167-A169 VanDerWaalsContact O-N 3.15Å; A169-L171 HydrophobicContact CB-CD1 4.37Å
170	I	98.8	Very high	98	Very high	51 Å²	51	35.4 Å²	35.4	26%	0.262	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	122.2	176.6	-52.8	-179.6	0	0	0	108.8	R47 I48 C49 Q72 S73	R47-I170 HydrophobicContact CG-CG2 3.87Å; I48-I170 WeakPolarHBondContact O-CA 3.46Å; C49-I170 HydrophobicContact CB-CG1 4Å; C49-I170 HydrophobicContact CB-CG2 4.49Å; Q72-I170 WeakPolarHBondContact CA-O 3.44Å; Q72-I170 HydrophobicContact CB-CB 4.05Å; Q72-I170 HydrophobicContact CB-CG2 3.91Å; Q72-I170 WeakPolarHBondContact CB-O 3.41Å; Q72-I170 HydrophobicContact CG-CG2 4.49Å; Q72-I170 PolarHBondContact N-O 3.08Å; S73-I170 PolarHBondContact N-O 2.97Å; S73-I170 VanDerWaalsContact N-O 3.16Å; S73-I170 PolarHBondContact O-N 3.11Å
171	L	98.9	Very high	97.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.7	178.3	-83	68.1	0	0	0	110.7	R47 I48 F69 K70 W77 I79 V163 V165 A169	R47-L171 WeakPolarHBondContact CA-O 3.33Å; I48-L171 HydrophobicContact CG2-CB 3.91Å; I48-L171 PolarHBondContact N-O 2.64Å; I48-L171 PolarHBondContact O-N 2.78Å; I48-L171 VanDerWaalsContact O-N 3.12Å; F69-L171 HydrophobicContact CB-CD2 4.29Å; K70-L171 WeakPolarHBondContact O-CA 3.36Å; W77-L171 HydrophobicContact CB-CD1 3.74Å; W77-L171 HydrophobicContact CB-CD2 4.25Å; W77-L171 HydrophobicContact CD2-CD2 4.43Å; W77-L171 HydrophobicContact CE3-CD2 4.2Å; W77-L171 HydrophobicContact CG-CD1 3.94Å; W77-L171 HydrophobicContact CG-CD2 4.46Å; I79-L171 HydrophobicContact CG2-CD2 3.76Å; V163-L171 HydrophobicContact CG2-CB 4.3Å; V163-L171 HydrophobicContact CG2-CD2 3.69Å; V165-L171 HydrophobicContact CG1-CD1 3.95Å; A169-L171 HydrophobicContact CB-CD1 4.37Å
172	D	98.7	Very high	97.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	133.9	164	-83.5	-20.8	0	0	0	109.6	K43 R46 R47 F69 K70 Q72	K43-D172 IonicContact NZ-OD1 3.41Å; K43-D172 IonicContact NZ-OD2 3.94Å; K43-D172 PolarHBondContact NZ-OD2 2.72Å; R46-D172 CarbonylContact O-C 3.58Å; R46-D172 VanDerWaalsContact O-CA 3.31Å; R46-D172 WeakPolarHBondContact O-CA 3.42Å; R47-D172 WeakPolarHBondContact CB-OD1 3.27Å; R47-D172 IonicContact CZ-OD1 2.83Å; R47-D172 VanDerWaalsContact CZ-OD1 3.27Å; R47-D172 IonicContact CZ-OD2 3.57Å; R47-D172 IonicContact NE-OD1 3.5Å; R47-D172 PolarHBondContact NE-OD1 2.87Å; R47-D172 IonicContact NE-OD2 3.62Å; R47-D172 VanDerWaalsContact NH2-CG 3.3Å; R47-D172 IonicContact NH2-OD1 3.65Å; R47-D172 PolarHBondContact NH2-OD1 3.45Å; R47-D172 IonicContact NH2-OD2 3.61Å; R47-D172 PolarHBondContact NH2-OD2 2.78Å; F69-D172 CarbonylContact C-O 3.51Å; F69-D172 VanDerWaalsContact CA-O 3.25Å; F69-D172 WeakPolarHBondContact CA-O 3.42Å; K70-D172 HydrophobicContact CB-CB 4.2Å; K70-D172 PolarHBondContact N-O 3.16Å; K70-D172 PolarHBondContact O-N 3.13Å; Q72-D172 HydrophobicContact CG-CB 4.4Å; Q72-D172 PolarHBondContact NE2-OD2 3.34Å
173	C	98.5	Very high	97.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.5	179.6	-48.8	0	0	0	0	110.5	L30 R46 F69 F175	L30-C173 HydrophobicContact CD2-CB 4.43Å; L30-C173 HydrophobicContact CG-CB 4.43Å; R46-C173 PolarHBondContact O-N 3.37Å; F69-C173 HydrophobicContact CD1-CB 4.09Å; F69-C173 HydrophobicContact CE1-CB 4.14Å; C173-F175 HydrophobicContact CB-CE2 3.89Å; C173-F175 HydrophobicContact CB-CZ 3.94Å
174	Q	98.1	Very high	97.7	Very high	13 Å²	13	48.6 Å²	48.6	6%	0.061	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	115.3	172.6	-54.3	-51.3	-43.5	0	0	109.4	E68 F178 Y179	E68-Q174 HydrophobicContact CB-CB 4.3Å; E68-Q174 PolarHBondContact N-O 3.29Å; E68-Q174 PolarHBondContact O-N 2.79Å; Q174-F178 HydrophobicContact CB-CD1 4.15Å; Q174-F178 WeakPolarHBondContact O-CE1 3.42Å; Q174-Y179 HydrophobicContact CG-CD2 3.91Å; Q174-Y179 HydrophobicContact CG-CE2 3.53Å
175	F	97.1	Very high	97.5	Very high	6 Å²	6	51 Å²	51	3%	0.026	29%	0.293	C	S	.	.	S	Bend	trans	-102	-4.8	171.9	-55.5	-68.2	0	0	0	112.3	V28 L30 A56 F67 P161 C173 F178 K188 I189	V28-F175 HydrophobicContact CB-CB 3.74Å; V28-F175 HydrophobicContact CB-CD2 4.38Å; V28-F175 HydrophobicContact CB-CG 4.12Å; V28-F175 HydrophobicContact CG1-CB 3.82Å; V28-F175 HydrophobicContact CG1-CD1 4.09Å; V28-F175 HydrophobicContact CG1-CD2 3.92Å; V28-F175 HydrophobicContact CG1-CG 3.66Å; V28-F175 WeakPolarHBondContact O-CD2 2.89Å; L30-F175 HydrophobicContact CD2-CE2 4.28Å; L30-F175 HydrophobicContact CD2-CZ 4.03Å; L30-F175 HydrophobicContact CG-CE2 4.43Å; A56-F175 HydrophobicContact CB-CD1 4.38Å; A56-F175 HydrophobicContact CB-CE1 3.69Å; A56-F175 HydrophobicContact CB-CE2 4.19Å; A56-F175 HydrophobicContact CB-CZ 3.56Å; F67-F175 HydrophobicContact CB-CD1 3.84Å; F67-F175 HydrophobicContact CB-CE1 4.34Å; F67-F175 HydrophobicContact CG-CD1 4.5Å; P161-F175 HydrophobicContact CB-CE1 3.77Å; P161-F175 HydrophobicContact CG-CD1 4.42Å; P161-F175 HydrophobicContact CG-CE1 4.05Å; C173-F175 HydrophobicContact CB-CE2 3.89Å; C173-F175 HydrophobicContact CB-CZ 3.94Å; F175-F178 VanDerWaalsContact C-CE1 3.44Å; F175-F178 WeakPolarHBondContact O-CZ 3.34Å; F175-K188 WeakPolarHBondContact O-CB 3.3Å; F175-I189 HydrophobicContact CD1-CD1 3.89Å
176	S	94.8	Very high	97.4	Very high	35 Å²	35	52.9 Å²	52.9	25%	0.245	30%	0.301	C	S	.	.	S	Bend	trans	-159	170	176.1	57.6	0	0	0	0	107.9	F178	S176-F178 PolarHBondContact O-N 3.41Å
177	E	94.3	Very high	97.3	Very high	162 Å²	162	56.5 Å²	56.5	76%	0.757	32%	0.316	S	S	*	.	S	Bend	trans	54	51.7	179	-59.6	177.5	179.2	0	0	112.2
178	F	98.1	Very high	97.2	Very high	42 Å²	42	56.8 Å²	56.8	18%	0.184	31%	0.313	C	S	.	.			trans	-65.1	150.5	-173.3	-53.9	-59.4	0	0	0	113.3	Y66 E68 Q174 F175 S176 H180 P182 K188	Y66-F178 AromaticContact CD1-CD1 3.94Å; Y66-F178 HydrophobicContact CD1-CD1 3.94Å; Y66-F178 AromaticContact CD1-CD2 3.81Å; Y66-F178 HydrophobicContact CD1-CD2 3.81Å; Y66-F178 AromaticContact CD1-CE1 3.92Å; Y66-F178 HydrophobicContact CD1-CE1 3.92Å; Y66-F178 AromaticContact CD1-CE2 3.77Å; Y66-F178 HydrophobicContact CD1-CE2 3.77Å; Y66-F178 AromaticContact CD1-CG 3.89Å; Y66-F178 HydrophobicContact CD1-CG 3.89Å; Y66-F178 AromaticContact CD1-CZ 3.83Å; Y66-F178 HydrophobicContact CD1-CZ 3.83Å; Y66-F178 HydrophobicContact CE1-CB 4.19Å; Y66-F178 AromaticContact CE1-CD1 3.98Å; Y66-F178 HydrophobicContact CE1-CD1 3.98Å; Y66-F178 HydrophobicContact CE1-CD2 4.1Å; Y66-F178 HydrophobicContact CE1-CE1 4.4Å; Y66-F178 AromaticContact CE1-CG 3.81Å; Y66-F178 HydrophobicContact CE1-CG 3.81Å; Y66-F178 VanDerWaalsContact O-CZ 3.31Å; Y66-F178 WeakPolarHBondContact O-CZ 3.46Å; E68-F178 HydrophobicContact CG-CB 4.47Å; E68-F178 HydrophobicContact CG-CD1 4.06Å; E68-F178 WeakPolarHBondContact OE2-CA 3.36Å; E68-F178 WeakPolarHBondContact OE2-CB 3.34Å; Q174-F178 HydrophobicContact CB-CD1 4.15Å; Q174-F178 WeakPolarHBondContact O-CE1 3.42Å; F175-F178 VanDerWaalsContact C-CE1 3.44Å; F175-F178 WeakPolarHBondContact O-CZ 3.34Å; S176-F178 PolarHBondContact O-N 3.41Å; F178-H180 WeakPolarHBondContact CB-O 3.46Å; F178-P182 HydrophobicContact CD2-CG 3.45Å; F178-P182 VanDerWaalsContact CD2-CG 3.45Å; F178-P182 HydrophobicContact CE2-CG 3.71Å; F178-P182 HydrophobicContact CG-CG 4.43Å; F178-K188 HydrophobicContact CE2-CB 3.89Å; F178-K188 HydrophobicContact CZ-CB 3.77Å
179	Y	98.3	Very high	97	Very high	102 Å²	102	52.5 Å²	52.5	40%	0.4	28%	0.282	S	S	.	.	S	Bend	trans	-69.7	-35.5	171.2	-65.9	-81.7	0	0	0	111.4	E68 K70 V129 Q174	E68-Y179 PolarHBondContact OE2-N 2.9Å; K70-Y179 HydrophobicContact CB-CE2 3.96Å; K70-Y179 HydrophobicContact CD-CE1 4.18Å; K70-Y179 HydrophobicContact CD-CE2 4.08Å; V129-Y179 HydrophobicContact CG1-CD2 4.13Å; V129-Y179 HydrophobicContact CG2-CD2 3.96Å; V129-Y179 HydrophobicContact CG2-CG 4.02Å; Q174-Y179 HydrophobicContact CG-CD2 3.91Å; Q174-Y179 HydrophobicContact CG-CE2 3.53Å
180	H	98.4	Very high	96.5	Very high	55 Å²	55	56.3 Å²	56.3	26%	0.255	30%	0.302	S	S	.	.	S	Bend	trans	-117.3	149.1	175.3	-55.2	-78.1	0	0	0	111.4	E68 N144 G145 F178 P182	E68-H180 WeakPolarHBondContact OE1-CA 3.18Å; E68-H180 VanDerWaalsContact OE1-CB 3.29Å; E68-H180 WeakPolarHBondContact OE1-CB 3.39Å; E68-H180 IonicContact OE1-CD2 2.64Å; E68-H180 IonicContact OE1-CG 2.95Å; E68-H180 PolarHBondContact OE1-N 2.82Å; N144-H180 WeakPolarHBondContact CA-NE2 3.48Å; N144-H180 PolarHBondContact O-CE1 3.37Å; G145-H180 PolarHBondContact N-CD2 2.85Å; F178-H180 WeakPolarHBondContact CB-O 3.46Å; H180-P182 WeakPolarHBondContact O-CD 3.46Å
181	T	97.8	Very high	95.8	Very high	130 Å²	130	56.5 Å²	56.5	80%	0.798	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-64.1	128	177	-52.8	0	0	0	0	109.7
182	P	97.7	Very high	94.7	Very high	35 Å²	35	62.8 Å²	62.8	23%	0.227	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-54.4	146.8	173.4	-26.3	34.1	0	0	0	111.8	Y66 F178 H180 F186	Y66-P182 HydrophobicContact CD1-CB 3.81Å; Y66-P182 HydrophobicContact CD1-CG 3.61Å; Y66-P182 HydrophobicContact CE1-CB 4.3Å; Y66-P182 HydrophobicContact CE1-CG 4.04Å; Y66-P182 HydrophobicContact CG-CB 3.95Å; Y66-P182 HydrophobicContact CG-CG 4.24Å; F178-P182 HydrophobicContact CD2-CG 3.45Å; F178-P182 VanDerWaalsContact CD2-CG 3.45Å; F178-P182 HydrophobicContact CE2-CG 3.71Å; F178-P182 HydrophobicContact CG-CG 4.43Å; H180-P182 WeakPolarHBondContact O-CD 3.46Å; P182-F186 HydrophobicContact CB-CB 4.44Å; P182-F186 WeakPolarHBondContact CB-O 3.47Å
183	P	97.1	Very high	93.1	Very high	17 Å²	17	69.1 Å²	69.1	11%	0.11	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-59.6	157.2	174.4	-22.8	34.1	0	0	0	112.2	T133 Y142 G185 F186	T133-P183 HydrophobicContact CG2-CG 3.79Å; Y142-P183 HydrophobicContact CD1-CG 4.27Å; Y142-P183 HydrophobicContact CE1-CB 4.38Å; Y142-P183 HydrophobicContact CE1-CG 3.48Å; Y142-P183 VanDerWaalsContact CE1-CG 3.48Å; Y142-P183 HydrophobicContact CE2-CG 3.84Å; Y142-P183 WeakPolarHBondContact OH-CG 3.33Å; P183-G185 PolarHBondContact O-N 3.45Å; P183-F186 HydrophobicContact CB-CD2 3.94Å; P183-F186 WeakPolarHBondContact O-CB 3.3Å; P183-F186 PolarHBondContact O-N 3.26Å
184	P	96.2	Very high	91.3	Very high	128 Å²	128	76.2 Å²	76.2	83%	0.831	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	126.3	-177.7	-27.8	35.4	0	0	0	113.6	F186	P184-F186 VanDerWaalsContact C-N 3.28Å; P184-F186 PolarHBondContact O-N 3.16Å
185	G	95.5	Very high	89.6	Confident	51 Å²	51	83.6 Å²	83.6	53%	0.526	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-1.4	180	0	0	0	0	0	115	K64 P183	K64-G185 WeakPolarHBondContact CB-O 3.25Å; K64-G185 WeakPolarHBondContact CD-O 3.45Å; P183-G185 PolarHBondContact O-N 3.45Å
186	F	97.1	Very high	88	Confident	38 Å²	38	95.5 Å²	95.5	17%	0.167	48%	0.484	C	S	.	.			trans	-96.1	140.1	171.6	-70.7	-96.9	0	0	0	111.5	K64 S65 T133 D135 P182 P183 P184	K64-F186 VanDerWaalsContact CA-CD1 3.4Å; K64-F186 HydrophobicContact CB-CB 4.43Å; K64-F186 HydrophobicContact CB-CD1 3.58Å; K64-F186 HydrophobicContact CB-CD2 4.37Å; K64-F186 HydrophobicContact CB-CE1 3.78Å; K64-F186 HydrophobicContact CB-CG 3.89Å; K64-F186 HydrophobicContact CB-CZ 4.29Å; K64-F186 HydrophobicContact CG-CD1 4.32Å; K64-F186 HydrophobicContact CG-CE1 4.07Å; K64-F186 HydrophobicContact CG-CE2 4.46Å; K64-F186 HydrophobicContact CG-CZ 4.15Å; K64-F186 VanDerWaalsContact O-CA 3.27Å; K64-F186 WeakPolarHBondContact O-CA 3.29Å; S65-F186 WeakPolarHBondContact O-CD1 3.49Å; T133-F186 VanDerWaalsContact CB-CE1 3.41Å; T133-F186 HydrophobicContact CG2-CB 4.46Å; T133-F186 HydrophobicContact CG2-CD1 3.56Å; T133-F186 HydrophobicContact CG2-CD2 4.12Å; T133-F186 HydrophobicContact CG2-CE1 3.74Å; T133-F186 HydrophobicContact CG2-CE2 4.24Å; T133-F186 HydrophobicContact CG2-CG 3.78Å; T133-F186 HydrophobicContact CG2-CZ 4.07Å; D135-F186 HydrophobicContact CB-CE1 3.99Å; D135-F186 HydrophobicContact CB-CZ 4.08Å; P182-F186 HydrophobicContact CB-CB 4.44Å; P182-F186 WeakPolarHBondContact CB-O 3.47Å; P183-F186 HydrophobicContact CB-CD2 3.94Å; P183-F186 WeakPolarHBondContact O-CB 3.3Å; P183-F186 PolarHBondContact O-N 3.26Å; P184-F186 VanDerWaalsContact C-N 3.28Å; P184-F186 PolarHBondContact O-N 3.16Å
187	E	95.5	Very high	87.7	Confident	121 Å²	121	98.6 Å²	98.6	57%	0.565	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	165.2	-173.4	-61.9	-172.9	169.9	0	0	112.3	K64 S65 Y66	K64-E187 PolarHBondContact O-N 2.9Å; S65-E187 CarbonylContact C-O 3.55Å; Y66-E187 PolarHBondContact N-O 2.95Å
188	K	95.2	Very high	87.3	Confident	110 Å²	110	95.2 Å²	95.2	48%	0.478	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	152.6	171.7	66.2	176.5	-176.8	178.1	0	111.1	Q62 F175 F178 L190	Q62-K188 PolarHBondContact NE2-O 2.84Å; F175-K188 WeakPolarHBondContact O-CB 3.3Å; F178-K188 HydrophobicContact CE2-CB 3.89Å; F178-K188 HydrophobicContact CZ-CB 3.77Å; K188-L190 HydrophobicContact CD-CD2 4.41Å; K188-L190 HydrophobicContact CG-CD2 4.07Å; K188-L190 PolarHBondContact O-N 2.83Å
189	I	93.3	Very high	86.7	Confident	6 Å²	6	98.2 Å²	98.2	3%	0.031	50%	0.498	C	S	.	.			trans	-68.8	129	178	-53.5	167.3	0	0	0	109.1	V28 A58 L60 F67 P161 F175	V28-I189 HydrophobicContact CG1-CD1 4.48Å; V28-I189 HydrophobicContact CG2-CB 4.08Å; V28-I189 HydrophobicContact CG2-CG2 4.02Å; A58-I189 HydrophobicContact CB-CG2 3.78Å; L60-I189 HydrophobicContact CD2-CD1 3.58Å; L60-I189 HydrophobicContact CD2-CG1 3.73Å; L60-I189 HydrophobicContact CD2-CG2 4.19Å; F67-I189 HydrophobicContact CB-CD1 4.35Å; F67-I189 HydrophobicContact CD1-CD1 3.99Å; F67-I189 HydrophobicContact CG-CD1 4.4Å; P161-I189 HydrophobicContact CG-CD1 3.34Å; F175-I189 HydrophobicContact CD1-CD1 3.89Å
190	L	86.7	Confident	86	Confident	81 Å²	81	97.9 Å²	97.9	42%	0.424	50%	0.504	S	S	.	.			trans	-111.5	142.3	176.1	-57.9	176.7	0	0	0	109.3	K188	K188-L190 HydrophobicContact CD-CD2 4.41Å; K188-L190 HydrophobicContact CG-CD2 4.07Å; K188-L190 PolarHBondContact O-N 2.83Å
191	F	85.1	Confident	85.3	Confident	55 Å²	55	100.6 Å²	100.6	24%	0.241	52%	0.52	C	S	.	.			trans	-67.6	150.8	164.4	-75.3	-85.8	0	0	0	109.6	M25 P26 V28 S57 A58	M25-F191 VanDerWaalsContact CE-C 3.5Å; M25-F191 HydrophobicContact CE-CB 3.48Å; M25-F191 VanDerWaalsContact CE-CB 3.48Å; M25-F191 WeakPolarHBondContact CE-O 3.49Å; P26-F191 HydrophobicContact CB-CE2 4.17Å; P26-F191 HydrophobicContact CG-CD2 3.86Å; P26-F191 HydrophobicContact CG-CE2 3.79Å; P26-F191 HydrophobicContact CG-CG 4.35Å; P26-F191 HydrophobicContact CG-CZ 4.21Å; P26-F191 WeakPolarHBondContact O-CD2 3.21Å; P26-F191 WeakPolarHBondContact O-CE2 3.41Å; V28-F191 HydrophobicContact CG2-CD2 4.11Å; V28-F191 HydrophobicContact CG2-CE2 3.73Å; V28-F191 HydrophobicContact CG2-CZ 4.37Å; S57-F191 WeakPolarHBondContact O-CE1 3.42Å; A58-F191 HydrophobicContact CB-CD1 4.01Å; A58-F191 HydrophobicContact CB-CE1 3.73Å; A58-F191 HydrophobicContact CB-CE2 4.26Å; A58-F191 HydrophobicContact CB-CG 4.4Å; A58-F191 HydrophobicContact CB-CZ 3.87Å
192	E	74.8	Confident	84.4	Confident	132 Å²	132	98.7 Å²	98.7	62%	0.617	50%	0.501	S	S	*	.			trans	-71.1	131.6	168	-78.2	179.6	174	0	0	110.2	H61 Q194	H61-E192 WeakPolarHBondContact CB-OE1 3.48Å; H61-E192 IonicContact CE1-OE1 3.8Å; H61-E192 IonicContact CE1-OE2 3.96Å; H61-E192 IonicContact CG-OE1 2.84Å; H61-E192 IonicContact ND1-OE1 3.82Å; H61-E192 PolarHBondContact ND1-OE1 3.5Å; H61-E192 IonicContact ND1-OE2 3.52Å; H61-E192 PolarHBondContact ND1-OE2 2.78Å; E192-Q194 PolarHBondContact O-N 3.47Å
193	Q	65.5	Low	83.5	Confident	132 Å²	132	103.2 Å²	103.2	62%	0.617	52%	0.521	S	S	*	.			trans	-82.6	110.6	166.1	-66.1	-173.8	-15	0	0	108.2	M25 I195	M25-Q193 HydrophobicContact CE-CG 3.58Å; M25-Q193 HydrophobicContact SD-CG 3.54Å; M25-Q193 VanDerWaalsContact SD-CG 3.54Å; M25-Q193 PolarHBondContact SD-NE2 3.35Å; Q193-I195 PolarHBondContact O-N 2.85Å; Q193-I195 VanDerWaalsContact O-N 3.16Å
194	Q	60.3	Low	82.5	Confident	150 Å²	150	109.8 Å²	109.8	70%	0.701	55%	0.552	S	S	*	*			trans	-72.5	105.7	164.8	-69.8	-175.9	-4.6	0	0	108	E192 F196	E192-Q194 PolarHBondContact O-N 3.47Å; Q194-F196 PolarHBondContact O-N 3.05Å
195	I	62.1	Low	81.3	Confident	167 Å²	167	108.3 Å²	108.3	86%	0.856	53%	0.529	S	S	*	.			trans	-75.9	112.8	164.5	2.4	174.5	0	0	0	106.2	Q193	Q193-I195 PolarHBondContact O-N 2.85Å; Q193-I195 VanDerWaalsContact O-N 3.16Å
196	F	64.5	Low	80	Confident	257 Å²	257	113.5 Å²	113.5	100%	1.127	53%	0.53	S	S	*	.			trans	-75.8	0	173	-64.6	-77.4	0	0	0	111	Q194	Q194-F196 PolarHBondContact O-N 3.05Å

Retrieved 196 of 196 residues in 341.3 ms (Link to these results)

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