A0A068BD71_MOUSE Loading...

MHC class II antigen A alpha isoform-004

AlphaFold DB , UniProt , Accession A0A068BD71, Species MOUSE (Mus musculus, Mouse), Gene H2-Aa, Length 173 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	40.9	Very low	56.7	Low	234 Å²	234	129.3 Å²	129.3	100%	1.153	68%	0.682	S	S	*	*				0	106.6	0	-73.8	169.4	177.7	0	0	108.2	R3	M1-R3 PolarHBondContact O-N 3.07Å
2	P	50.9	Low	57.2	Low	130 Å²	130	127 Å²	127	84%	0.844	67%	0.67	S	S	*	*			trans	-72.3	111.7	-177.5	29.9	-30	0	0	0	108.1	S4	P2-S4 PolarHBondContact O-N 2.86Å
3	R	52.7	Low	57.6	Low	230 Å²	230	121.2 Å²	121.2	87%	0.868	65%	0.651	S	S	*	*			trans	-60.5	110.8	171.4	-79.1	177.6	164.9	152.6	-4.8	107.1	M1 R5	M1-R3 PolarHBondContact O-N 3.07Å; R3-R5 PolarHBondContact O-N 2.95Å
4	S	51.6	Low	57.7	Low	60 Å²	60	120.9 Å²	120.9	42%	0.42	65%	0.648	S	S	.	*			trans	-54	100.3	-173.3	-172.9	0	0	0	0	110.2	P2 A6 L7	P2-S4 PolarHBondContact O-N 2.86Å; S4-A6 PolarHBondContact O-N 3.09Å; S4-A6 VanDerWaalsContact O-N 3.14Å; S4-L7 PolarHBondContact O-N 2.81Å
5	R	56.9	Low	57.9	Low	212 Å²	212	117.7 Å²	117.7	80%	0.8	64%	0.635	S	S	*	*	H	α-helix	trans	-56.6	-26.3	175.4	-75.2	176.9	139	-173.5	-6.6	111.5	R3 I8 L9	R3-R5 PolarHBondContact O-N 2.95Å; R5-I8 PolarHBondContact O-N 3.17Å; R5-L9 VanDerWaalsContact O-CD1 3.24Å; R5-L9 WeakPolarHBondContact O-CD1 3.26Å; R5-L9 PolarHBondContact O-N 3.19Å; R5-L9 VanDerWaalsContact O-N 3.12Å
6	A	60.2	Low	58	Low	75 Å²	75	115 Å²	115	62%	0.62	62%	0.624	S	S	*	*	H	α-helix	trans	-64.5	-37	174.9	0	0	0	0	0	113.2	S4 G10	S4-A6 PolarHBondContact O-N 3.09Å; S4-A6 VanDerWaalsContact O-N 3.14Å; A6-G10 PolarHBondContact O-N 2.82Å
7	L	60.2	Low	58.1	Low	125 Å²	125	116.2 Å²	116.2	65%	0.654	63%	0.626	S	S	*	*	H	α-helix	trans	-67.3	-38.7	176.1	-82.9	165.9	0	0	0	111.5	S4 G10 V11	S4-L7 PolarHBondContact O-N 2.81Å; L7-G10 PolarHBondContact O-N 3.06Å; L7-V11 VanDerWaalsContact O-CG2 3.29Å; L7-V11 WeakPolarHBondContact O-CG2 3.44Å; L7-V11 PolarHBondContact O-N 3.42Å
8	I	60.1	Low	58.1	Low	100 Å²	100	116.8 Å²	116.8	51%	0.513	63%	0.628	S	S	.	*	H	α-helix	trans	-67.9	-45.3	180	-61.1	175.1	0	0	0	110.7	R5 G10 V11 L12	R5-I8 PolarHBondContact O-N 3.17Å; I8-G10 VanDerWaalsContact C-N 3.33Å; I8-G10 PolarHBondContact O-N 3.13Å; I8-V11 PolarHBondContact O-N 3.47Å; I8-L12 HydrophobicContact CG2-CD1 3.9Å; I8-L12 WeakPolarHBondContact O-CB 3.31Å; I8-L12 WeakPolarHBondContact O-CD1 2.93Å; I8-L12 PolarHBondContact O-N 2.84Å; I8-L12 VanDerWaalsContact O-N 3.09Å
9	L	63	Low	58.1	Low	124 Å²	124	115.7 Å²	115.7	65%	0.649	63%	0.631	S	S	*	*	H	α-helix	trans	-63.3	-37.7	174.7	-90.3	94.8	0	0	0	112.5	R5 A13	R5-L9 VanDerWaalsContact O-CD1 3.24Å; R5-L9 WeakPolarHBondContact O-CD1 3.26Å; R5-L9 PolarHBondContact O-N 3.19Å; R5-L9 VanDerWaalsContact O-N 3.12Å; L9-A13 WeakPolarHBondContact O-CB 3.27Å; L9-A13 PolarHBondContact O-N 3.47Å
10	G	60.4	Low	57.9	Low	43 Å²	43	116.8 Å²	116.8	44%	0.443	64%	0.635	S	S	.	*	H	α-helix	trans	-66.7	-41.3	178.2	0	0	0	0	0	113.5	A6 L7 I8 L14	A6-G10 PolarHBondContact O-N 2.82Å; L7-G10 PolarHBondContact O-N 3.06Å; I8-G10 VanDerWaalsContact C-N 3.33Å; I8-G10 PolarHBondContact O-N 3.13Å; G10-L14 WeakPolarHBondContact O-CB 3.04Å; G10-L14 PolarHBondContact O-N 3.38Å
11	V	66.5	Low	57.9	Low	89 Å²	89	116.3 Å²	116.3	54%	0.539	64%	0.639	S	S	.	*	H	α-helix	trans	-67.2	-43.5	176.3	173.8	0	0	0	0	111	L7 I8 A13 L14 T15	L7-V11 VanDerWaalsContact O-CG2 3.29Å; L7-V11 WeakPolarHBondContact O-CG2 3.44Å; L7-V11 PolarHBondContact O-N 3.42Å; I8-V11 PolarHBondContact O-N 3.47Å; V11-A13 PolarHBondContact O-N 2.62Å; V11-L14 PolarHBondContact O-N 2.76Å; V11-T15 HydrophobicContact CG1-CG2 4.49Å; V11-T15 WeakPolarHBondContact O-CG2 3.42Å; V11-T15 PolarHBondContact O-N 3.01Å; V11-T15 PolarHBondContact O-OG1 3.41Å
12	L	62.7	Low	58.5	Low	102 Å²	102	108 Å²	108	53%	0.534	61%	0.613	S	S	.	*	H	α-helix	trans	-59.4	-46.1	175.4	-92.5	146.1	0	0	0	111.8	I8 L14 T15 T16	I8-L12 HydrophobicContact CG2-CD1 3.9Å; I8-L12 WeakPolarHBondContact O-CB 3.31Å; I8-L12 WeakPolarHBondContact O-CD1 2.93Å; I8-L12 PolarHBondContact O-N 2.84Å; I8-L12 VanDerWaalsContact O-N 3.09Å; L12-L14 PolarHBondContact O-N 2.73Å; L12-T15 WeakPolarHBondContact CA-OG1 3.45Å; L12-T15 PolarHBondContact O-N 3.35Å; L12-T15 PolarHBondContact O-OG1 2.99Å; L12-T16 WeakPolarHBondContact O-CG2 3.22Å; L12-T16 PolarHBondContact O-N 3.46Å; L12-T16 PolarHBondContact O-OG1 3.35Å
13	A	62.4	Low	58.8	Low	51 Å²	51	105 Å²	105	42%	0.421	61%	0.607	S	S	.	*	H	α-helix	trans	-62.5	-40.3	176.5	0	0	0	0	0	112.5	L9 V11 T16 M17	L9-A13 WeakPolarHBondContact O-CB 3.27Å; L9-A13 PolarHBondContact O-N 3.47Å; V11-A13 PolarHBondContact O-N 2.62Å; A13-T16 WeakPolarHBondContact CA-OG1 3.19Å; A13-T16 PolarHBondContact O-N 2.88Å; A13-T16 PolarHBondContact O-OG1 3.4Å; A13-M17 WeakPolarHBondContact O-CB 3.27Å; A13-M17 WeakPolarHBondContact O-CG 3.2Å; A13-M17 PolarHBondContact O-N 3.36Å
14	L	58.7	Low	59.2	Low	118 Å²	118	102.5 Å²	102.5	62%	0.618	61%	0.605	S	S	*	*	H	α-helix	trans	-66.2	-43.4	176.5	-160.9	76.4	0	0	0	111.3	G10 V11 L12 M17 L18	G10-L14 WeakPolarHBondContact O-CB 3.04Å; G10-L14 PolarHBondContact O-N 3.38Å; V11-L14 PolarHBondContact O-N 2.76Å; L12-L14 PolarHBondContact O-N 2.73Å; L14-M17 PolarHBondContact O-N 2.73Å; L14-L18 HydrophobicContact CG-CD1 4.15Å; L14-L18 WeakPolarHBondContact O-CB 3.44Å; L14-L18 WeakPolarHBondContact O-CD1 3.36Å; L14-L18 WeakPolarHBondContact O-CG 3.23Å; L14-L18 PolarHBondContact O-N 2.91Å
15	T	60.9	Low	59.6	Low	73 Å²	73	107 Å²	107	45%	0.448	62%	0.624	S	S	.	*	H	α-helix	trans	-66.3	-36.1	176.3	49.9	0	0	0	0	112.9	V11 L12 S19	V11-T15 HydrophobicContact CG1-CG2 4.49Å; V11-T15 WeakPolarHBondContact O-CG2 3.42Å; V11-T15 PolarHBondContact O-N 3.01Å; V11-T15 PolarHBondContact O-OG1 3.41Å; L12-T15 WeakPolarHBondContact CA-OG1 3.45Å; L12-T15 PolarHBondContact O-N 3.35Å; L12-T15 PolarHBondContact O-OG1 2.99Å; T15-S19 WeakPolarHBondContact O-CB 3.25Å; T15-S19 PolarHBondContact O-N 3.33Å
16	T	59.5	Low	60.3	Low	74 Å²	74	103.6 Å²	103.6	45%	0.454	62%	0.622	S	S	.	*	H	α-helix	trans	-70.3	-37.8	174.4	49.5	0	0	0	0	111.7	L12 A13 S19 L20	L12-T16 WeakPolarHBondContact O-CG2 3.22Å; L12-T16 PolarHBondContact O-N 3.46Å; L12-T16 PolarHBondContact O-OG1 3.35Å; A13-T16 WeakPolarHBondContact CA-OG1 3.19Å; A13-T16 PolarHBondContact O-N 2.88Å; A13-T16 PolarHBondContact O-OG1 3.4Å; T16-S19 CarbonylContact O-C 3.59Å; T16-S19 PolarHBondContact O-N 3.48Å; T16-L20 WeakPolarHBondContact O-CD1 3.44Å; T16-L20 PolarHBondContact O-N 2.82Å
17	M	60.8	Low	61.5	Low	135 Å²	135	105.2 Å²	105.2	67%	0.665	62%	0.619	S	S	*	*	H	α-helix	trans	-67.3	-38.2	175.2	-69.7	-68.8	-82.7	0	0	112.1	A13 L14 S19 L20	A13-M17 WeakPolarHBondContact O-CB 3.27Å; A13-M17 WeakPolarHBondContact O-CG 3.2Å; A13-M17 PolarHBondContact O-N 3.36Å; L14-M17 PolarHBondContact O-N 2.73Å; M17-S19 VanDerWaalsContact C-N 3.29Å; M17-S19 PolarHBondContact O-N 3.38Å; M17-L20 PolarHBondContact O-N 2.99Å
18	L	56.9	Low	63	Low	127 Å²	127	103.5 Å²	103.5	67%	0.665	61%	0.607	S	S	*	*	H	α-helix	trans	-65.5	-30.9	171.3	-80.9	152.1	0	0	0	112.3	L14	L14-L18 HydrophobicContact CG-CD1 4.15Å; L14-L18 WeakPolarHBondContact O-CB 3.44Å; L14-L18 WeakPolarHBondContact O-CD1 3.36Å; L14-L18 WeakPolarHBondContact O-CG 3.23Å; L14-L18 PolarHBondContact O-N 2.91Å
19	S	58.9	Low	64.7	Low	96 Å²	96	102.7 Å²	102.7	67%	0.671	60%	0.602	S	S	*	*	H	α-helix	trans	-80.2	-17.5	176.4	-173.6	0	0	0	0	114.1	T15 T16 M17	T15-S19 WeakPolarHBondContact O-CB 3.25Å; T15-S19 PolarHBondContact O-N 3.33Å; T16-S19 CarbonylContact O-C 3.59Å; T16-S19 PolarHBondContact O-N 3.48Å; M17-S19 VanDerWaalsContact C-N 3.29Å; M17-S19 PolarHBondContact O-N 3.38Å
20	L	54.4	Low	66.3	Low	137 Å²	137	98.5 Å²	98.5	72%	0.717	59%	0.585	S	S	*	*	H	α-helix	trans	-84	-12.6	176.7	-94.1	143.4	0	0	0	112.8	T16 M17 G22	T16-L20 WeakPolarHBondContact O-CD1 3.44Å; T16-L20 PolarHBondContact O-N 2.82Å; M17-L20 PolarHBondContact O-N 2.99Å; L20-G22 PolarHBondContact O-N 3.46Å; L20-G22 VanDerWaalsContact O-N 3.13Å
21	C	57.3	Low	68.1	Low	108 Å²	108	96.7 Å²	96.7	73%	0.73	57%	0.565	S	S	*	*			trans	-80.7	59	155.7	-69.9	0	0	0	0	108.8	G23	C21-G23 PolarHBondContact O-N 3.02Å
22	G	54.1	Low	69.6	Low	59 Å²	59	98 Å²	98	61%	0.608	57%	0.565	S	S	*	*			trans	-57.9	127	160.6	0	0	0	0	0	106.9	L20	L20-G22 PolarHBondContact O-N 3.46Å; L20-G22 VanDerWaalsContact O-N 3.13Å
23	G	57.5	Low	71.3	Confident	68 Å²	68	93.3 Å²	93.3	70%	0.701	54%	0.541	S	S	*	.			trans	-52.7	142.7	-178.9	0	0	0	0	0	110.6	C21 D25	C21-G23 PolarHBondContact O-N 3.02Å; G23-D25 PolarHBondContact O-N 3.41Å
24	E	59.7	Low	73	Confident	177 Å²	177	94.6 Å²	94.6	83%	0.827	54%	0.544	S	S	*	.			trans	-50.7	115.3	154	-102.9	106	97.4	0	0	105.8	D26	E24-D26 PolarHBondContact O-N 2.9Å
25	D	61.3	Low	74.9	Confident	153 Å²	153	90 Å²	90	82%	0.818	52%	0.521	S	S	*	.			trans	-57.8	109.7	163.6	-81.5	-45.6	0	0	0	105.1	G23 I27	G23-D25 PolarHBondContact O-N 3.41Å; D25-I27 VanDerWaalsContact C-N 3.32Å; D25-I27 PolarHBondContact O-N 2.8Å
26	D	70.9	Confident	76.7	Confident	142 Å²	142	90.4 Å²	90.4	76%	0.759	52%	0.516	S	S	*	.			trans	-62.3	98.9	173.6	-73.7	-49.3	0	0	0	106.4	E24 E28	E24-D26 PolarHBondContact O-N 2.9Å; D26-E28 PolarHBondContact O-N 2.93Å
27	I	84.6	Confident	78.5	Confident	109 Å²	109	88.6 Å²	88.6	56%	0.559	51%	0.506	S	S	*	.			trans	-65.9	119.1	179.5	-58.6	174.3	0	0	0	106.6	D25 E29 F57	D25-I27 VanDerWaalsContact C-N 3.32Å; D25-I27 PolarHBondContact O-N 2.8Å; I27-E29 HydrophobicContact CG2-CG 4.46Å; I27-F57 HydrophobicContact CB-CD1 4.45Å; I27-F57 HydrophobicContact CB-CE1 4.13Å; I27-F57 HydrophobicContact CG2-CD1 4.49Å; I27-F57 WeakPolarHBondContact O-CD1 3.31Å; I27-F57 WeakPolarHBondContact O-CE1 3.35Å
28	E	93.3	Very high	80.3	Confident	89 Å²	89	89.2 Å²	89.2	42%	0.416	51%	0.505	S	S	.	.			trans	-116.3	120.4	175.9	-66.5	179.1	171.8	0	0	108.7	D26 W112	D26-E28 PolarHBondContact O-N 2.93Å; E28-W112 VanDerWaalsContact CD-CB 3.45Å; E28-W112 HydrophobicContact CG-CB 4.34Å; E28-W112 WeakPolarHBondContact OE1-CB 3.4Å; E28-W112 VanDerWaalsContact OE2-C 3.3Å; E28-W112 WeakPolarHBondContact OE2-CB 3.3Å
29	E	94.9	Very high	82.2	Confident	83 Å²	83	85.8 Å²	85.8	39%	0.388	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-100.2	137.4	179.8	-68.8	-67	164.7	0	0	110.1	I27 P31 F57 H111	I27-E29 HydrophobicContact CG2-CG 4.46Å; E29-P31 VanDerWaalsContact O-CD 3.26Å; E29-P31 WeakPolarHBondContact O-CD 3.4Å; E29-F57 HydrophobicContact CB-CB 4.03Å; E29-F57 HydrophobicContact CG-CB 4.04Å; E29-F57 PolarHBondContact N-O 3.42Å; E29-H111 PolarHBondContact O-CE1 2.81Å; E29-H111 PolarHBondContact O-ND1 2.77Å
30	A	97.2	Very high	83.9	Confident	36 Å²	36	86.8 Å²	86.8	30%	0.298	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-74.4	116.1	176.1	0	0	0	0	0	110.2	N55 G113 L114	A30-N55 PolarHBondContact O-ND2 3Å; A30-G113 WeakPolarHBondContact CB-O 3.27Å; A30-L114 HydrophobicContact CB-CD2 4.01Å
31	P	97.9	Very high	85.8	Confident	4 Å²	4	82.5 Å²	82.5	3%	0.026	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-72.5	152.2	180	30.6	-37	0	0	0	112.1	E29 V53 D54 I56 I61 V109 H111 L114	E29-P31 VanDerWaalsContact O-CD 3.26Å; E29-P31 WeakPolarHBondContact O-CD 3.4Å; P31-V53 HydrophobicContact CB-CG1 3.79Å; P31-D54 CarbonylContact C-O 3.58Å; P31-D54 WeakPolarHBondContact CA-O 3.31Å; P31-D54 WeakPolarHBondContact CB-O 3.39Å; P31-I56 HydrophobicContact CB-CG1 4.08Å; P31-I61 HydrophobicContact CB-CD1 4.29Å; P31-I61 HydrophobicContact CG-CD1 4.22Å; P31-V109 HydrophobicContact CG-CG1 4.26Å; P31-H111 HydrophobicContact CG-CB 3.63Å; P31-L114 HydrophobicContact CG-CD1 3.95Å; P31-L114 HydrophobicContact CG-CG 4.19Å
32	Q	98.1	Very high	87.5	Confident	116 Å²	116	81.7 Å²	81.7	54%	0.542	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.9	178.5	-64.4	-62.5	-18.4	0	0	110.6	V53 D54	Q32-V53 WeakPolarHBondContact O-CA 3.39Å; Q32-D54 PolarHBondContact N-O 2.91Å; Q32-D54 PolarHBondContact O-N 3.34Å
33	A	98.4	Very high	89.4	Confident	4 Å²	4	83.2 Å²	83.2	3%	0.033	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140	-178.6	0	0	0	0	0	112.2	F52 V53 V109 K120	A33-F52 CarbonylContact C-O 3.55Å; A33-F52 WeakPolarHBondContact CA-O 3.24Å; A33-V53 HydrophobicContact CB-CG2 4.12Å; A33-V109 HydrophobicContact CB-CG2 3.87Å; A33-K120 HydrophobicContact CB-CD 4.39Å; A33-K120 HydrophobicContact CB-CG 3.53Å; A33-K120 VanDerWaalsContact O-CD 3.22Å; A33-K120 WeakPolarHBondContact O-CD 3.46Å; A33-K120 WeakPolarHBondContact O-CE 3.33Å; A33-K120 WeakPolarHBondContact O-CG 3.26Å; A33-K120 PolarHBondContact O-NZ 3.08Å; A33-K120 VanDerWaalsContact O-NZ 3.13Å
34	T	98.6	Very high	91.1	Very high	78 Å²	78	82.6 Å²	82.6	48%	0.479	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.3	173.8	-52	0	0	0	0	109.5	F36 C51 F52	T34-F36 HydrophobicContact CG2-CD1 4.2Å; T34-C51 WeakPolarHBondContact O-CA 3.48Å; T34-F52 PolarHBondContact N-O 3.47Å; T34-F52 PolarHBondContact O-N 2.9Å
35	V	98.6	Very high	92.8	Very high	21 Å²	21	79.4 Å²	79.4	13%	0.127	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.4	178.9	179.9	0	0	0	0	110	L49 I50 C51 W65 C107 K120 W122	V35-L49 HydrophobicContact CG1-CD2 4.4Å; V35-I50 VanDerWaalsContact CA-O 3.3Å; V35-I50 WeakPolarHBondContact CA-O 3.27Å; V35-C51 HydrophobicContact CG2-CB 4.19Å; V35-W65 HydrophobicContact CG1-CH2 4.05Å; V35-W65 HydrophobicContact CG1-CZ3 4.15Å; V35-C107 HydrophobicContact CG2-CB 3.48Å; V35-C107 VanDerWaalsContact CG2-CB 3.48Å; V35-K120 HydrophobicContact CG2-CB 3.58Å; V35-W122 HydrophobicContact CB-CB 4.27Å; V35-W122 HydrophobicContact CG1-CB 3.62Å; V35-W122 HydrophobicContact CG1-CG 3.9Å
36	F	98	Very high	94.5	Very high	82 Å²	82	77.2 Å²	77.2	36%	0.36	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	152.5	177.5	54	-86.3	0	0	0	111.5	T34 I50 F52	T34-F36 HydrophobicContact CG2-CD1 4.2Å; F36-I50 HydrophobicContact CD2-CB 4.23Å; F36-I50 HydrophobicContact CD2-CD1 4.38Å; F36-I50 HydrophobicContact CE1-CG2 4.4Å; F36-I50 HydrophobicContact CE2-CB 3.92Å; F36-I50 HydrophobicContact CE2-CD1 3.84Å; F36-I50 HydrophobicContact CE2-CG1 4.38Å; F36-I50 HydrophobicContact CE2-CG2 4.11Å; F36-I50 HydrophobicContact CZ-CB 4.08Å; F36-I50 HydrophobicContact CZ-CG2 3.85Å; F36-I50 PolarHBondContact N-O 3.27Å; F36-I50 PolarHBondContact O-N 3.48Å; F36-F52 HydrophobicContact CE1-CB 3.84Å; F36-F52 HydrophobicContact CZ-CB 4.35Å
37	P	97.9	Very high	95.8	Very high	37 Å²	37	71 Å²	71	24%	0.24	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	150.6	175.6	33.5	-35.7	0	0	0	111.2	S39 V41 T48 L49 W122	P37-S39 VanDerWaalsContact C-N 3.31Å; P37-S39 PolarHBondContact O-N 2.86Å; P37-V41 HydrophobicContact CB-CG2 3.86Å; P37-V41 HydrophobicContact CG-CG2 3.79Å; P37-T48 CarbonylContact C-O 3.56Å; P37-L49 HydrophobicContact CB-CD2 4.27Å; P37-W122 HydrophobicContact CB-CZ2 4.42Å; P37-W122 HydrophobicContact CG-CZ2 4.46Å
38	K	97.6	Very high	96.5	Very high	147 Å²	147	67.1 Å²	67.1	64%	0.639	38%	0.378	S	S	*	.	S	Bend	trans	-65	-33.7	176.9	178.3	177.3	172.7	62.9	0	112.9	T48 I50	K38-T48 WeakPolarHBondContact CB-O 3.33Å; K38-T48 PolarHBondContact N-O 3.4Å; K38-I50 HydrophobicContact CB-CD1 4.07Å
39	S	96.3	Very high	96.7	Very high	56 Å²	56	62.9 Å²	62.9	39%	0.392	36%	0.358	S	S	.	.	S	Bend	trans	-142.6	164.8	-179.1	52	0	0	0	0	110.5	P37 V41 N47	P37-S39 VanDerWaalsContact C-N 3.31Å; P37-S39 PolarHBondContact O-N 2.86Å; S39-V41 PolarHBondContact O-N 3.31Å; S39-N47 PolarHBondContact N-OD1 3.3Å; S39-N47 PolarHBondContact O-ND2 3.07Å; S39-N47 PolarHBondContact OG-ND2 3.46Å; S39-N47 PolarHBondContact OG-OD1 3.06Å
40	P	95.1	Very high	96.9	Very high	116 Å²	116	59.8 Å²	59.8	75%	0.753	34%	0.344	S	S	*	.			trans	-48.2	137.1	174.2	-28.5	36.2	0	0	0	112	N47	P40-N47 PolarHBondContact O-ND2 3.48Å
41	V	95	Very high	97	Very high	48 Å²	48	58 Å²	58	29%	0.291	33%	0.33	S	S	.	.			trans	-82.7	122.3	-172.5	-177.4	0	0	0	0	109.4	P37 S39 P99 W122 P124	P37-V41 HydrophobicContact CB-CG2 3.86Å; P37-V41 HydrophobicContact CG-CG2 3.79Å; S39-V41 PolarHBondContact O-N 3.31Å; V41-P99 HydrophobicContact CG1-CB 3.63Å; V41-P99 HydrophobicContact CG1-CG 3.79Å; V41-W122 HydrophobicContact CG1-CH2 4.39Å; V41-W122 HydrophobicContact CG2-CH2 4.17Å; V41-W122 HydrophobicContact CG2-CZ2 3.77Å; V41-P124 HydrophobicContact CG1-CB 4.25Å
42	L	93.5	Very high	97	Very high	90 Å²	90	60.5 Å²	60.5	47%	0.471	34%	0.34	S	S	.	.			trans	-125	123.9	173	-62	175.8	0	0	0	107.8	G44 Q45	L42-G44 PolarHBondContact O-N 3.38Å; L42-Q45 HydrophobicContact CB-CB 4.12Å; L42-Q45 HydrophobicContact CB-CG 4.02Å; L42-Q45 PolarHBondContact O-N 2.96Å; L42-Q45 VanDerWaalsContact O-N 3.13Å
43	L	93.1	Very high	97.1	Very high	91 Å²	91	55 Å²	55	48%	0.476	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	138.1	-178.5	-61.6	-180	0	0	0	110.9	Q45 P99 I126	L43-Q45 PolarHBondContact O-N 3.44Å; L43-Q45 VanDerWaalsContact O-N 3.17Å; L43-P99 HydrophobicContact CD2-CB 4.28Å; L43-I126 HydrophobicContact CD1-CD1 4.25Å; L43-I126 HydrophobicContact CD2-CD1 4.4Å
44	G	92.6	Very high	97	Very high	55 Å²	55	57.3 Å²	57.3	57%	0.567	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	-5.1	-178.7	0	0	0	0	0	115.7	L42 P99	L42-G44 PolarHBondContact O-N 3.38Å; G44-P99 PolarHBondContact N-O 2.77Å
45	Q	95.6	Very high	97	Very high	110 Å²	110	55.8 Å²	55.8	51%	0.514	32%	0.315	S	S	.	.	S	Bend	trans	-98.5	129.6	176.1	-62.1	-171.1	28.8	0	0	111.1	L42 L43 N47 P99	L42-Q45 HydrophobicContact CB-CB 4.12Å; L42-Q45 HydrophobicContact CB-CG 4.02Å; L42-Q45 PolarHBondContact O-N 2.96Å; L42-Q45 VanDerWaalsContact O-N 3.13Å; L43-Q45 PolarHBondContact O-N 3.44Å; L43-Q45 VanDerWaalsContact O-N 3.17Å; Q45-N47 PolarHBondContact O-N 2.94Å; Q45-P99 WeakPolarHBondContact O-CD 3.41Å
46	P	97.9	Very high	97	Very high	107 Å²	107	54.8 Å²	54.8	70%	0.695	31%	0.309	S	S	*	.			trans	-54.1	136.6	179	-26.2	34.2	0	0	0	113.1
47	N	97.8	Very high	96.9	Very high	12 Å²	12	54.6 Å²	54.6	6%	0.064	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	-177.7	177.7	-157.2	-24.3	0	0	0	109.9	S39 P40 Q45 F97 P99	S39-N47 PolarHBondContact N-OD1 3.3Å; S39-N47 PolarHBondContact O-ND2 3.07Å; S39-N47 PolarHBondContact OG-ND2 3.46Å; S39-N47 PolarHBondContact OG-OD1 3.06Å; P40-N47 PolarHBondContact O-ND2 3.48Å; Q45-N47 PolarHBondContact O-N 2.94Å; N47-F97 HydrophobicContact CB-CD1 4.32Å; N47-F97 HydrophobicContact CB-CE1 3.71Å; N47-F97 HydrophobicContact CB-CZ 4.23Å; N47-F97 PolarHBondContact N-O 2.85Å; N47-F97 PolarHBondContact O-N 2.9Å; N47-P99 HydrophobicContact CB-CG 4.21Å
48	T	98.5	Very high	96.7	Very high	28 Å²	28	54.1 Å²	54.1	17%	0.172	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	124.1	179.1	-54	0	0	0	0	109.2	P37 K38 Y94 L95	P37-T48 CarbonylContact C-O 3.56Å; K38-T48 WeakPolarHBondContact CB-O 3.33Å; K38-T48 PolarHBondContact N-O 3.4Å; T48-Y94 HydrophobicContact CG2-CD1 4.11Å; T48-L95 CarbonylContact C-O 3.54Å; T48-L95 VanDerWaalsContact CA-O 3.31Å; T48-L95 WeakPolarHBondContact CA-O 3.43Å
49	L	98.6	Very high	96.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	142.3	165.9	-70.2	175.9	0	0	0	109.6	V35 P37 W65 Y94 L95 F97 Y105 W122	V35-L49 HydrophobicContact CG1-CD2 4.4Å; P37-L49 HydrophobicContact CB-CD2 4.27Å; L49-W65 HydrophobicContact CB-CH2 3.58Å; L49-W65 HydrophobicContact CB-CZ2 4.33Å; L49-W65 HydrophobicContact CB-CZ3 3.87Å; L49-W65 HydrophobicContact CD1-CZ3 4.01Å; L49-Y94 CarbonylContact O-C 3.58Å; L49-Y94 VanDerWaalsContact O-CA 3.3Å; L49-Y94 WeakPolarHBondContact O-CA 3.43Å; L49-L95 HydrophobicContact CB-CB 4.47Å; L49-L95 PolarHBondContact N-O 3.28Å; L49-L95 PolarHBondContact O-N 3.41Å; L49-F97 HydrophobicContact CB-CE1 4.46Å; L49-F97 HydrophobicContact CD1-CE1 4.4Å; L49-F97 HydrophobicContact CD1-CZ 4.43Å; L49-F97 HydrophobicContact CD2-CE1 3.98Å; L49-F97 HydrophobicContact CD2-CZ 3.98Å; L49-F97 HydrophobicContact CG-CD1 3.96Å; L49-F97 HydrophobicContact CG-CE1 3.56Å; L49-F97 HydrophobicContact CG-CZ 3.87Å; L49-Y105 HydrophobicContact CD1-CD1 4.02Å; L49-Y105 HydrophobicContact CD1-CD2 3.95Å; L49-Y105 HydrophobicContact CD1-CG 3.58Å; L49-W122 HydrophobicContact CD1-CD2 4.07Å; L49-W122 HydrophobicContact CD1-CE3 3.61Å; L49-W122 HydrophobicContact CD1-CZ3 4.05Å; L49-W122 HydrophobicContact CD2-CD2 3.44Å; L49-W122 VanDerWaalsContact CD2-CD2 3.44Å; L49-W122 HydrophobicContact CD2-CE3 3.68Å; L49-W122 HydrophobicContact CD2-CG 3.99Å; L49-W122 HydrophobicContact CD2-CH2 4Å; L49-W122 HydrophobicContact CD2-CZ2 3.78Å; L49-W122 HydrophobicContact CD2-CZ3 3.95Å; L49-W122 HydrophobicContact CG-CD2 4.41Å; L49-W122 HydrophobicContact CG-CE3 4.24Å; L49-W122 HydrophobicContact CG-CZ3 4.45Å
50	I	98.9	Very high	96.6	Very high	17 Å²	17	50 Å²	50	9%	0.087	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.9	179.1	-52.7	179.4	0	0	0	106.8	V35 F36 K38 L92 Y94	V35-I50 VanDerWaalsContact CA-O 3.3Å; V35-I50 WeakPolarHBondContact CA-O 3.27Å; F36-I50 HydrophobicContact CD2-CB 4.23Å; F36-I50 HydrophobicContact CD2-CD1 4.38Å; F36-I50 HydrophobicContact CE1-CG2 4.4Å; F36-I50 HydrophobicContact CE2-CB 3.92Å; F36-I50 HydrophobicContact CE2-CD1 3.84Å; F36-I50 HydrophobicContact CE2-CG1 4.38Å; F36-I50 HydrophobicContact CE2-CG2 4.11Å; F36-I50 HydrophobicContact CZ-CB 4.08Å; F36-I50 HydrophobicContact CZ-CG2 3.85Å; F36-I50 PolarHBondContact N-O 3.27Å; F36-I50 PolarHBondContact O-N 3.48Å; K38-I50 HydrophobicContact CB-CD1 4.07Å; I50-L92 HydrophobicContact CG2-CD2 3.96Å; I50-Y94 HydrophobicContact CB-CD1 4.49Å; I50-Y94 HydrophobicContact CD1-CD1 4.36Å; I50-Y94 HydrophobicContact CD1-CE1 4.06Å; I50-Y94 HydrophobicContact CG1-CD1 3.83Å; I50-Y94 HydrophobicContact CG1-CE1 3.97Å; I50-Y94 HydrophobicContact CG2-CD1 4.31Å; I50-Y94 HydrophobicContact CG2-CE1 4.03Å
51	C	98.8	Very high	96.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	104.7	167	-172.3	0	0	0	0	108.1	T34 V35 W65 L92 S93 C107	T34-C51 WeakPolarHBondContact O-CA 3.48Å; V35-C51 HydrophobicContact CG2-CB 4.19Å; C51-W65 HydrophobicContact CB-CH2 3.7Å; C51-W65 HydrophobicContact CB-CZ2 3.48Å; C51-W65 VanDerWaalsContact CB-CZ2 3.48Å; C51-L92 WeakPolarHBondContact O-CA 3.27Å; C51-S93 PolarHBondContact N-O 3.41Å; C51-S93 PolarHBondContact O-N 3.43Å; C51-C107 HydrophobicContact CB-CB 3.65Å; C51-C107 WeakPolarHBondContact CB-SG 3.04Å; C51-C107 WeakPolarHBondContact SG-CB 3.46Å; C51-C107 CovalentContact SG-SG 2.03Å; C51-C107 PolarHBondContact SG-SG 2.9Å
52	F	98.8	Very high	96.9	Very high	56 Å²	56	47 Å²	47	25%	0.246	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	120.5	173.2	173.9	-108.3	0	0	0	108.6	A33 T34 F36 D54 H90 L92	A33-F52 CarbonylContact C-O 3.55Å; A33-F52 WeakPolarHBondContact CA-O 3.24Å; T34-F52 PolarHBondContact N-O 3.47Å; T34-F52 PolarHBondContact O-N 2.9Å; F36-F52 HydrophobicContact CE1-CB 3.84Å; F36-F52 HydrophobicContact CZ-CB 4.35Å; F52-D54 HydrophobicContact CD1-CB 4.45Å; F52-D54 HydrophobicContact CE1-CB 3.62Å; F52-D54 HydrophobicContact CZ-CB 3.76Å; F52-H90 HydrophobicContact CE2-CB 3.87Å; F52-H90 AromaticContact CE2-CD2 3.79Å; F52-H90 AromaticContact CE2-CG 3.98Å; F52-H90 HydrophobicContact CZ-CB 4.17Å; F52-L92 HydrophobicContact CD2-CD1 4.3Å; F52-L92 HydrophobicContact CD2-CD2 4.37Å; F52-L92 HydrophobicContact CD2-CG 4.04Å
53	V	98.7	Very high	97.2	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.6	178.2	-169.4	0	0	0	0	108.9	P31 Q32 A33 I56 I61 I63 H90 K91 V109	P31-V53 HydrophobicContact CB-CG1 3.79Å; Q32-V53 WeakPolarHBondContact O-CA 3.39Å; A33-V53 HydrophobicContact CB-CG2 4.12Å; V53-I56 HydrophobicContact CB-CD1 4.2Å; V53-I56 HydrophobicContact CG1-CD1 4.03Å; V53-I56 HydrophobicContact CG1-CG1 4.02Å; V53-I61 HydrophobicContact CB-CD1 4.5Å; V53-I61 HydrophobicContact CG1-CD1 3.62Å; V53-I63 HydrophobicContact CB-CD1 4.3Å; V53-I63 HydrophobicContact CG2-CD1 3.7Å; V53-I63 HydrophobicContact CG2-CG1 4.31Å; V53-H90 CarbonylContact O-C 3.49Å; V53-H90 WeakPolarHBondContact O-CA 3.3Å; V53-H90 VanDerWaalsContact O-CB 3.3Å; V53-H90 WeakPolarHBondContact O-CB 3.3Å; V53-K91 PolarHBondContact N-O 2.96Å; V53-K91 PolarHBondContact O-N 3.27Å; V53-V109 HydrophobicContact CG1-CG1 4.11Å; V53-V109 HydrophobicContact CG2-CG2 3.88Å
54	D	98.3	Very high	97.4	Very high	52 Å²	52	40.4 Å²	40.4	28%	0.278	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	173.4	-175.3	-157.2	5.2	0	0	0	111.4	P31 Q32 F52 I56 N84 H90	P31-D54 CarbonylContact C-O 3.58Å; P31-D54 WeakPolarHBondContact CA-O 3.31Å; P31-D54 WeakPolarHBondContact CB-O 3.39Å; Q32-D54 PolarHBondContact N-O 2.91Å; Q32-D54 PolarHBondContact O-N 3.34Å; F52-D54 HydrophobicContact CD1-CB 4.45Å; F52-D54 HydrophobicContact CE1-CB 3.62Å; F52-D54 HydrophobicContact CZ-CB 3.76Å; D54-I56 VanDerWaalsContact C-N 3.27Å; D54-I56 PolarHBondContact O-N 3.41Å; D54-N84 PolarHBondContact OD1-ND2 3.4Å; D54-H90 HydrophobicContact CB-CB 4.47Å
55	N	97.4	Very high	97.7	Very high	47 Å²	47	37.9 Å²	37.9	25%	0.251	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55.7	39.5	-179.3	-163.4	50.7	0	0	0	113	A30 F89	A30-N55 PolarHBondContact O-ND2 3Å; N55-F89 PolarHBondContact N-O 3.02Å
56	I	97.8	Very high	97.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	115.1	-179.2	-51.7	169.7	0	0	0	108.6	P31 V53 D54 P58 I61 F81 F89 K91	P31-I56 HydrophobicContact CB-CG1 4.08Å; V53-I56 HydrophobicContact CB-CD1 4.2Å; V53-I56 HydrophobicContact CG1-CD1 4.03Å; V53-I56 HydrophobicContact CG1-CG1 4.02Å; D54-I56 VanDerWaalsContact C-N 3.27Å; D54-I56 PolarHBondContact O-N 3.41Å; I56-P58 WeakPolarHBondContact CG2-O 3.3Å; I56-I61 HydrophobicContact CD1-CD1 3.92Å; I56-I61 HydrophobicContact CG1-CD1 4Å; I56-I61 HydrophobicContact CG2-CB 4.42Å; I56-I61 HydrophobicContact CG2-CD1 4.28Å; I56-F81 HydrophobicContact CD1-CD1 4.43Å; I56-F81 HydrophobicContact CD1-CE1 4.34Å; I56-F81 HydrophobicContact CG2-CE1 4.11Å; I56-F89 HydrophobicContact CB-CB 4.15Å; I56-F89 VanDerWaalsContact CB-O 3.22Å; I56-F89 WeakPolarHBondContact CB-O 3.3Å; I56-F89 WeakPolarHBondContact CG1-O 3.22Å; I56-F89 PolarHBondContact N-O 3.44Å; I56-F89 WeakPolarHBondContact O-CD2 3.39Å; I56-F89 PolarHBondContact O-N 3.37Å; I56-K91 HydrophobicContact CD1-CB 3.81Å
57	F	96.1	Very high	97.9	Very high	77 Å²	77	33.8 Å²	33.8	34%	0.338	18%	0.175	S	C	.	.	B	Isolated β-bridge	trans	-154.4	127	168.7	-170.9	-92	0	0	0	110.5	I27 E29 F89 H111	I27-F57 HydrophobicContact CB-CD1 4.45Å; I27-F57 HydrophobicContact CB-CE1 4.13Å; I27-F57 HydrophobicContact CG2-CD1 4.49Å; I27-F57 WeakPolarHBondContact O-CD1 3.31Å; I27-F57 WeakPolarHBondContact O-CE1 3.35Å; E29-F57 HydrophobicContact CB-CB 4.03Å; E29-F57 HydrophobicContact CG-CB 4.04Å; E29-F57 PolarHBondContact N-O 3.42Å; F57-F89 HydrophobicContact CD2-CE2 4.35Å; F57-H111 PolarHBondContact O-CE1 2.03Å; F57-H111 PolarHBondContact O-NE2 2.91Å
58	P	95.1	Very high	97.9	Very high	27 Å²	27	36.3 Å²	36.3	18%	0.175	19%	0.188	C	C	.	.	S	Bend	cis	-67.8	167.3	-4	28.9	-35.2	0	0	0	112.7	I56 V60 H111 W112	I56-P58 WeakPolarHBondContact CG2-O 3.3Å; P58-V60 PolarHBondContact O-N 2.91Å; P58-H111 PolarHBondContact O-NE2 2.86Å; P58-H111 VanDerWaalsContact O-NE2 3.08Å; P58-W112 HydrophobicContact CG-CE3 3.56Å; P58-W112 HydrophobicContact CG-CZ3 3.58Å
59	P	95.8	Very high	97.8	Very high	47 Å²	47	39.4 Å²	39.4	31%	0.305	21%	0.211	S	C	.	.	S	Bend	trans	-76.2	58.8	-178.5	33	-36.8	0	0	0	112.3	F81 F89	P59-F81 HydrophobicContact CB-CB 4.48Å; P59-F81 HydrophobicContact CB-CD1 3.91Å; P59-F81 HydrophobicContact CB-CD2 4.02Å; P59-F81 HydrophobicContact CB-CE1 4.09Å; P59-F81 HydrophobicContact CB-CE2 4.2Å; P59-F81 HydrophobicContact CB-CG 3.87Å; P59-F81 HydrophobicContact CB-CZ 4.23Å; P59-F81 WeakPolarHBondContact O-CE2 3.4Å; P59-F81 WeakPolarHBondContact O-CZ 3.27Å; P59-F89 HydrophobicContact CB-CD1 4.29Å; P59-F89 HydrophobicContact CB-CD2 3.78Å; P59-F89 HydrophobicContact CB-CE1 4.39Å; P59-F89 HydrophobicContact CB-CE2 3.93Å; P59-F89 HydrophobicContact CB-CG 3.97Å; P59-F89 HydrophobicContact CB-CZ 4.22Å; P59-F89 HydrophobicContact CG-CD2 4.18Å; P59-F89 HydrophobicContact CG-CE2 3.83Å; P59-F89 HydrophobicContact CG-CZ 4.05Å
60	V	96.2	Very high	97.8	Very high	71 Å²	71	47 Å²	47	43%	0.43	24%	0.244	S	C	.	.			trans	-133.3	114.1	175.1	-179	0	0	0	0	107.1	P58 H111 W112	P58-V60 PolarHBondContact O-N 2.91Å; V60-H111 PolarHBondContact O-CD2 3Å; V60-W112 HydrophobicContact CB-CH2 4.12Å; V60-W112 HydrophobicContact CB-CZ2 4.36Å; V60-W112 HydrophobicContact CB-CZ3 4.38Å; V60-W112 HydrophobicContact CG1-CH2 4.07Å; V60-W112 HydrophobicContact CG1-CZ2 3.88Å; V60-W112 HydrophobicContact CG2-CH2 4.05Å; V60-W112 HydrophobicContact CG2-CZ3 4.36Å
61	I	97.9	Very high	97.8	Very high	23 Å²	23	50.1 Å²	50.1	12%	0.118	27%	0.267	C	S	.	.			trans	-150.6	147.1	-175.1	-159.7	166.3	0	0	0	110.4	P31 V53 I56 I63 F81 K91 V109 E110 H111	P31-I61 HydrophobicContact CB-CD1 4.29Å; P31-I61 HydrophobicContact CG-CD1 4.22Å; V53-I61 HydrophobicContact CB-CD1 4.5Å; V53-I61 HydrophobicContact CG1-CD1 3.62Å; I56-I61 HydrophobicContact CD1-CD1 3.92Å; I56-I61 HydrophobicContact CG1-CD1 4Å; I56-I61 HydrophobicContact CG2-CB 4.42Å; I56-I61 HydrophobicContact CG2-CD1 4.28Å; I61-I63 HydrophobicContact CD1-CG1 4.47Å; I61-I63 HydrophobicContact CG1-CG1 4.35Å; I61-I63 HydrophobicContact CG2-CD1 4.34Å; I61-I63 HydrophobicContact CG2-CG1 4.26Å; I61-F81 HydrophobicContact CB-CE1 4.49Å; I61-F81 HydrophobicContact CG2-CE1 3.69Å; I61-F81 HydrophobicContact CG2-CZ 3.86Å; I61-K91 HydrophobicContact CG2-CD 4Å; I61-V109 HydrophobicContact CD1-CG1 3.58Å; I61-V109 HydrophobicContact CG1-CG1 3.94Å; I61-E110 VanDerWaalsContact CG1-O 3.31Å; I61-E110 WeakPolarHBondContact CG1-O 3.16Å; I61-H111 HydrophobicContact CD1-CB 4.48Å; I61-H111 HydrophobicContact CG1-CB 4.19Å
62	N	98.4	Very high	97.7	Very high	76 Å²	76	52 Å²	52	41%	0.406	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.2	168.6	-171	29.8	0	0	0	109.5	V109 E110	N62-V109 WeakPolarHBondContact O-CA 3.3Å; N62-E110 HydrophobicContact CB-CB 4.17Å; N62-E110 PolarHBondContact N-O 3.42Å; N62-E110 PolarHBondContact ND2-OE2 2.99Å; N62-E110 PolarHBondContact O-N 3.11Å
63	I	98.6	Very high	97.7	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.041	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.2	176.9	-54	172.2	0	0	0	106.9	V53 I61 K91 C107 K108	V53-I63 HydrophobicContact CB-CD1 4.3Å; V53-I63 HydrophobicContact CG2-CD1 3.7Å; V53-I63 HydrophobicContact CG2-CG1 4.31Å; I61-I63 HydrophobicContact CD1-CG1 4.47Å; I61-I63 HydrophobicContact CG1-CG1 4.35Å; I61-I63 HydrophobicContact CG2-CD1 4.34Å; I61-I63 HydrophobicContact CG2-CG1 4.26Å; I63-K91 HydrophobicContact CD1-CB 4.35Å; I63-K91 HydrophobicContact CD1-CD 3.97Å; I63-K91 HydrophobicContact CD1-CG 4.35Å; I63-C107 VanDerWaalsContact CG2-SG 3.6Å; I63-K108 WeakPolarHBondContact CA-O 3.41Å
64	T	98.7	Very high	97.7	Very high	36 Å²	36	61.1 Å²	61.1	22%	0.221	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.2	179.7	52.5	0	0	0	0	110.2	K108	T64-K108 PolarHBondContact N-O 3.47Å; T64-K108 PolarHBondContact O-N 3.25Å; T64-K108 WeakPolarHBondContact OG1-CB 3.39Å
65	W	98.8	Very high	97.6	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.008	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	137.7	174.6	-72.9	96.3	0	0	0	110.4	V35 L49 C51 S71 V72 V76 S93 L95 C107	V35-W65 HydrophobicContact CG1-CH2 4.05Å; V35-W65 HydrophobicContact CG1-CZ3 4.15Å; L49-W65 HydrophobicContact CB-CH2 3.58Å; L49-W65 HydrophobicContact CB-CZ2 4.33Å; L49-W65 HydrophobicContact CB-CZ3 3.87Å; L49-W65 HydrophobicContact CD1-CZ3 4.01Å; C51-W65 HydrophobicContact CB-CH2 3.7Å; C51-W65 HydrophobicContact CB-CZ2 3.48Å; C51-W65 VanDerWaalsContact CB-CZ2 3.48Å; W65-S71 WeakPolarHBondContact O-CA 3.34Å; W65-V72 HydrophobicContact CB-CG2 3.62Å; W65-V72 PolarHBondContact O-N 2.86Å; W65-V76 HydrophobicContact CB-CG2 4.4Å; W65-V76 HydrophobicContact CG-CG2 4.32Å; W65-S93 PolarHBondContact NE1-OG 2.92Å; W65-L95 HydrophobicContact CB-CD2 4.06Å; W65-L95 HydrophobicContact CD2-CB 3.66Å; W65-L95 HydrophobicContact CD2-CD2 3.9Å; W65-L95 HydrophobicContact CD2-CG 4.38Å; W65-L95 HydrophobicContact CE3-CB 4.14Å; W65-L95 HydrophobicContact CE3-CD2 3.81Å; W65-L95 HydrophobicContact CG-CB 3.92Å; W65-L95 HydrophobicContact CG-CD2 4.03Å; W65-L95 HydrophobicContact CG-CG 4.41Å; W65-L95 HydrophobicContact CZ2-CB 4.11Å; W65-C107 HydrophobicContact CE3-CB 4.33Å; W65-C107 HydrophobicContact CH2-CB 4.27Å; W65-C107 HydrophobicContact CZ3-CB 4.07Å
66	L	98.7	Very high	97.7	Very high	26 Å²	26	60.5 Å²	60.5	14%	0.136	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.2	169.9	-49.5	173.9	0	0	0	108.8	K70 Y105 D106 K108 L119	L66-K70 CarbonylContact C-O 3.51Å; L66-K70 VanDerWaalsContact CA-O 3.24Å; L66-K70 WeakPolarHBondContact CA-O 3.3Å; L66-Y105 CarbonylContact O-C 3.59Å; L66-Y105 VanDerWaalsContact O-CA 3.27Å; L66-Y105 WeakPolarHBondContact O-CA 3.33Å; L66-D106 HydrophobicContact CB-CB 4.15Å; L66-D106 HydrophobicContact CD1-CB 4.26Å; L66-D106 PolarHBondContact N-O 2.96Å; L66-D106 PolarHBondContact O-N 2.83Å; L66-K108 HydrophobicContact CD1-CB 4.4Å; L66-L119 HydrophobicContact CD1-CD2 3.8Å
67	R	98.1	Very high	97.7	Very high	105 Å²	105	67.8 Å²	67.8	40%	0.396	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121	166	-179.6	-178.3	175.9	179.2	-0.5	107.5	S69 K70 V72 D103 I104 Y105	R67-S69 PolarHBondContact O-N 3.2Å; R67-K70 PolarHBondContact N-O 3.02Å; R67-K70 PolarHBondContact O-N 2.88Å; R67-V72 HydrophobicContact CB-CG1 3.76Å; R67-V72 HydrophobicContact CB-CG2 4.41Å; R67-D103 IonicContact CZ-OD1 3.97Å; R67-D103 IonicContact CZ-OD2 3.42Å; R67-D103 VanDerWaalsContact NE-CG 3.26Å; R67-D103 IonicContact NE-OD1 2.66Å; R67-D103 PolarHBondContact NE-OD1 2.74Å; R67-D103 IonicContact NE-OD2 2.82Å; R67-D103 PolarHBondContact NE-OD2 2.91Å; R67-D103 IonicContact NH2-OD1 2.68Å; R67-D103 PolarHBondContact NH2-OD1 2.8Å; R67-D103 IonicContact NH2-OD2 3.19Å; R67-D103 PolarHBondContact NH2-OD2 2.99Å; R67-I104 WeakPolarHBondContact CA-O 3.33Å; R67-Y105 HydrophobicContact CB-CD1 4.1Å; R67-Y105 HydrophobicContact CB-CE1 3.98Å; R67-Y105 HydrophobicContact CG-CD1 4.2Å; R67-Y105 HydrophobicContact CG-CE1 3.73Å
68	N	97.3	Very high	97.8	Very high	65 Å²	65	66.7 Å²	66.7	35%	0.348	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	47.4	-175.3	-53.9	-36.6	0	0	0	111.5	K70 D103 I104	N68-K70 PolarHBondContact O-N 3.01Å; N68-K70 VanDerWaalsContact O-N 3.11Å; N68-D103 PolarHBondContact ND2-OD1 3Å; N68-I104 PolarHBondContact N-O 3.45Å; N68-I104 VanDerWaalsContact OD1-CG1 3.31Å; N68-I104 WeakPolarHBondContact OD1-CG1 3.31Å; N68-I104 PolarHBondContact OD1-N 2.84Å
69	S	97.4	Very high	98	Very high	92 Å²	92	66.6 Å²	66.6	64%	0.643	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	8.8	-177.3	-45.2	0	0	0	0	116.5	R67	R67-S69 PolarHBondContact O-N 3.2Å
70	K	98.1	Very high	98.1	Very high	160 Å²	160	68.6 Å²	68.6	70%	0.696	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.4	176.3	-64.4	178.9	-175.7	175.5	0	110.8	L66 R67 N68 V72	L66-K70 CarbonylContact C-O 3.51Å; L66-K70 VanDerWaalsContact CA-O 3.24Å; L66-K70 WeakPolarHBondContact CA-O 3.3Å; R67-K70 PolarHBondContact N-O 3.02Å; R67-K70 PolarHBondContact O-N 2.88Å; N68-K70 PolarHBondContact O-N 3.01Å; N68-K70 VanDerWaalsContact O-N 3.11Å; K70-V72 PolarHBondContact O-N 2.91Å
71	S	98.1	Very high	98.2	Very high	82 Å²	82	68.4 Å²	68.4	57%	0.573	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	134.4	177.9	-174.5	0	0	0	0	111.9	W65	W65-S71 WeakPolarHBondContact O-CA 3.34Å
72	V	98	Very high	98.2	Very high	39 Å²	39	70.5 Å²	70.5	24%	0.236	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.3	174.9	-64.4	0	0	0	0	110.1	W65 R67 K70 L95	W65-V72 HydrophobicContact CB-CG2 3.62Å; W65-V72 PolarHBondContact O-N 2.86Å; R67-V72 HydrophobicContact CB-CG1 3.76Å; R67-V72 HydrophobicContact CB-CG2 4.41Å; K70-V72 PolarHBondContact O-N 2.91Å; V72-L95 HydrophobicContact CG2-CD1 4Å; V72-L95 HydrophobicContact CG2-CD2 4.08Å
73	T	98	Very high	98.2	Very high	107 Å²	107	71.6 Å²	71.6	66%	0.656	39%	0.394	S	S	*	.			trans	-119.8	-20.6	177.9	53.9	0	0	0	0	112.3	G75 V76	T73-G75 PolarHBondContact O-N 3.04Å; T73-V76 WeakPolarHBondContact O-CB 3.4Å; T73-V76 PolarHBondContact O-N 3.18Å
74	D	98.2	Very high	98.1	Very high	141 Å²	141	72.9 Å²	72.9	75%	0.754	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	128.1	179.7	-65.4	-27.2	0	0	0	110.3	V76	D74-V76 PolarHBondContact O-N 2.91Å
75	G	97.4	Very high	98	Very high	38 Å²	38	83.1 Å²	83.1	39%	0.392	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	12.5	-177.8	0	0	0	0	0	114.5	T73 T96	T73-G75 PolarHBondContact O-N 3.04Å; G75-T96 VanDerWaalsContact CA-OG1 3.25Å; G75-T96 WeakPolarHBondContact CA-OG1 3.28Å; G75-T96 PolarHBondContact O-N 2.93Å; G75-T96 PolarHBondContact O-OG1 2.84Å
76	V	98.7	Very high	97.7	Very high	48 Å²	48	88 Å²	88	29%	0.291	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	136.3	174.2	179.4	0	0	0	0	110.8	W65 T73 D74 Y94 L95	W65-V76 HydrophobicContact CB-CG2 4.4Å; W65-V76 HydrophobicContact CG-CG2 4.32Å; T73-V76 WeakPolarHBondContact O-CB 3.4Å; T73-V76 PolarHBondContact O-N 3.18Å; D74-V76 PolarHBondContact O-N 2.91Å; V76-Y94 WeakPolarHBondContact CA-O 3.44Å; V76-L95 HydrophobicContact CG2-CD1 3.72Å
77	Y	98.3	Very high	97.4	Very high	154 Å²	154	93.9 Å²	93.9	60%	0.604	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	147.7	173.8	170	-102.4	0	0	0	110	S93 Y94	Y77-S93 CarbonylContact O-C 3.59Å; Y77-S93 WeakPolarHBondContact O-CA 2.99Å; Y77-Y94 AromaticContact CD1-CD2 3.55Å; Y77-Y94 HydrophobicContact CD1-CD2 3.55Å; Y77-Y94 AromaticContact CD1-CE2 3.98Å; Y77-Y94 HydrophobicContact CD1-CE2 3.98Å; Y77-Y94 HydrophobicContact CD1-CG 4.35Å; Y77-Y94 HydrophobicContact CE1-CD2 4.16Å; Y77-Y94 HydrophobicContact CE1-CE2 4.13Å; Y77-Y94 PolarHBondContact N-O 2.92Å; Y77-Y94 WeakPolarHBondContact O-CD2 3.45Å; Y77-Y94 PolarHBondContact O-N 3.29Å
78	E	98.3	Very high	97.2	Very high	54 Å²	54	89.3 Å²	89.3	25%	0.252	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.9	179.7	-49.8	-162	154.1	0	0	112	K91 L92 S93	E78-K91 WeakPolarHBondContact OE2-CE 3.43Å; E78-K91 IonicContact OE2-NZ 3.56Å; E78-K91 PolarHBondContact OE2-NZ 3.45Å; E78-L92 CarbonylContact C-O 3.58Å; E78-L92 VanDerWaalsContact CA-O 3.3Å; E78-L92 WeakPolarHBondContact CA-O 3.31Å; E78-S93 WeakPolarHBondContact CG-OG 2.9Å; E78-S93 WeakPolarHBondContact OE1-CB 3.04Å; E78-S93 PolarHBondContact OE1-OG 3.31Å
79	T	98.6	Very high	97.3	Very high	25 Å²	25	88.3 Å²	88.3	15%	0.153	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-78.7	165.5	171.1	65.9	0	0	0	0	111.6	K91 L92 Y94	T79-K91 WeakPolarHBondContact O-CE 3.38Å; T79-L92 HydrophobicContact CG2-CB 4.01Å; T79-L92 HydrophobicContact CG2-CD1 4.37Å; T79-L92 PolarHBondContact N-O 3.44Å; T79-L92 PolarHBondContact OG1-N 2.91Å; T79-L92 VanDerWaalsContact OG1-N 3.08Å; T79-Y94 HydrophobicContact CG2-CE2 3.95Å
80	S	98.2	Very high	97.3	Very high	89 Å²	89	85.7 Å²	85.7	62%	0.622	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-64.9	169.2	156.8	59.3	0	0	0	0	110.6	L82	S80-L82 PolarHBondContact O-N 2.94Å
81	F	98.4	Very high	97.4	Very high	66 Å²	66	79.4 Å²	79.4	29%	0.289	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-62.1	134.4	167.6	-64.4	-78.6	0	0	0	110.4	I56 P59 I61 F89 K91	I56-F81 HydrophobicContact CD1-CD1 4.43Å; I56-F81 HydrophobicContact CD1-CE1 4.34Å; I56-F81 HydrophobicContact CG2-CE1 4.11Å; P59-F81 HydrophobicContact CB-CB 4.48Å; P59-F81 HydrophobicContact CB-CD1 3.91Å; P59-F81 HydrophobicContact CB-CD2 4.02Å; P59-F81 HydrophobicContact CB-CE1 4.09Å; P59-F81 HydrophobicContact CB-CE2 4.2Å; P59-F81 HydrophobicContact CB-CG 3.87Å; P59-F81 HydrophobicContact CB-CZ 4.23Å; P59-F81 WeakPolarHBondContact O-CE2 3.4Å; P59-F81 WeakPolarHBondContact O-CZ 3.27Å; I61-F81 HydrophobicContact CB-CE1 4.49Å; I61-F81 HydrophobicContact CG2-CE1 3.69Å; I61-F81 HydrophobicContact CG2-CZ 3.86Å; F81-F89 HydrophobicContact CB-CB 4.29Å; F81-F89 HydrophobicContact CB-CD1 3.76Å; F81-F89 HydrophobicContact CB-CE1 4.49Å; F81-F89 HydrophobicContact CB-CG 4.31Å; F81-F89 HydrophobicContact CD1-CB 4.13Å; F81-K91 HydrophobicContact CE1-CD 4.22Å
82	L	98.1	Very high	97.4	Very high	68 Å²	68	76.9 Å²	76.9	36%	0.356	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.2	177.7	-63.8	170.2	0	0	0	108	S80 F89 H90 L92	S80-L82 PolarHBondContact O-N 2.94Å; L82-F89 CarbonylContact O-C 3.5Å; L82-F89 WeakPolarHBondContact O-CA 3.3Å; L82-H90 VanDerWaalsContact CB-CE1 3.44Å; L82-H90 WeakPolarHBondContact CB-CE1 3.34Å; L82-H90 VanDerWaalsContact CB-NE2 3.27Å; L82-H90 WeakPolarHBondContact CB-NE2 3.19Å; L82-H90 VanDerWaalsContact CD1-NE2 3.31Å; L82-H90 WeakPolarHBondContact CD1-NE2 3.33Å; L82-H90 PolarHBondContact N-O 3.41Å; L82-H90 PolarHBondContact O-N 3.36Å; L82-L92 HydrophobicContact CD1-CD1 4.06Å
83	V	97.8	Very high	97.4	Very high	99 Å²	99	75 Å²	75	60%	0.6	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.7	-173.4	-178.2	0	0	0	0	110.2	F89	V83-F89 HydrophobicContact CG2-CD1 3.99Å; V83-F89 HydrophobicContact CG2-CE1 3.69Å
84	N	96.9	Very high	97.5	Very high	34 Å²	34	72.8 Å²	72.8	18%	0.182	36%	0.363	C	S	.	.			trans	-85.1	169.7	171.1	-72.8	-35.5	0	0	0	112	D54 D86 H87 S88 H90	D54-N84 PolarHBondContact OD1-ND2 3.4Å; N84-D86 WeakPolarHBondContact CB-OD1 3.38Å; N84-D86 PolarHBondContact O-N 3.16Å; N84-H87 PolarHBondContact O-N 3.48Å; N84-S88 WeakPolarHBondContact CB-O 3.49Å; N84-S88 WeakPolarHBondContact CB-OG 3.48Å; N84-S88 PolarHBondContact N-O 3.47Å; N84-S88 PolarHBondContact ND2-OG 3.19Å; N84-H90 PolarHBondContact OD1-CE1 3.48Å; N84-H90 PolarHBondContact OD1-ND1 3.04Å
85	R	96.1	Very high	97.5	Very high	252 Å²	252	66.4 Å²	66.4	95%	0.951	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-26.7	178.5	-70.1	-174	178.1	137.4	0.3	113.5	H87	R85-H87 VanDerWaalsContact C-N 3.3Å
86	D	93.9	Very high	97.5	Very high	105 Å²	105	68.5 Å²	68.5	56%	0.561	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	10.8	179.1	60.2	3.5	0	0	0	113	N84 S88	N84-D86 WeakPolarHBondContact CB-OD1 3.38Å; N84-D86 PolarHBondContact O-N 3.16Å; D86-S88 PolarHBondContact O-N 2.89Å; D86-S88 WeakPolarHBondContact OD1-CB 3.47Å; D86-S88 PolarHBondContact OD1-N 2.81Å; D86-S88 PolarHBondContact OD1-OG 2.86Å
87	H	91	Very high	97.5	Very high	149 Å²	149	66.9 Å²	66.9	69%	0.69	32%	0.324	S	S	*	.	S	Bend	trans	68.4	4.2	-177.2	-49.8	-75.1	0	0	0	115.8	N84 R85	N84-H87 PolarHBondContact O-N 3.48Å; R85-H87 VanDerWaalsContact C-N 3.3Å
88	S	95.3	Very high	97.4	Very high	8 Å²	8	64.3 Å²	64.3	6%	0.056	32%	0.319	C	S	.	.			trans	-71.6	174.6	162.3	72.7	0	0	0	0	110.6	N84 D86	N84-S88 WeakPolarHBondContact CB-O 3.49Å; N84-S88 WeakPolarHBondContact CB-OG 3.48Å; N84-S88 PolarHBondContact N-O 3.47Å; N84-S88 PolarHBondContact ND2-OG 3.19Å; D86-S88 PolarHBondContact O-N 2.89Å; D86-S88 WeakPolarHBondContact OD1-CB 3.47Å; D86-S88 PolarHBondContact OD1-N 2.81Å; D86-S88 PolarHBondContact OD1-OG 2.86Å
89	F	98.2	Very high	97.2	Very high	45 Å²	45	61.9 Å²	61.9	20%	0.197	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	153.7	177	-59	-97.9	0	0	0	111.6	N55 I56 F57 P59 F81 L82 V83	N55-F89 PolarHBondContact N-O 3.02Å; I56-F89 HydrophobicContact CB-CB 4.15Å; I56-F89 VanDerWaalsContact CB-O 3.22Å; I56-F89 WeakPolarHBondContact CB-O 3.3Å; I56-F89 WeakPolarHBondContact CG1-O 3.22Å; I56-F89 PolarHBondContact N-O 3.44Å; I56-F89 WeakPolarHBondContact O-CD2 3.39Å; I56-F89 PolarHBondContact O-N 3.37Å; F57-F89 HydrophobicContact CD2-CE2 4.35Å; P59-F89 HydrophobicContact CB-CD1 4.29Å; P59-F89 HydrophobicContact CB-CD2 3.78Å; P59-F89 HydrophobicContact CB-CE1 4.39Å; P59-F89 HydrophobicContact CB-CE2 3.93Å; P59-F89 HydrophobicContact CB-CG 3.97Å; P59-F89 HydrophobicContact CB-CZ 4.22Å; P59-F89 HydrophobicContact CG-CD2 4.18Å; P59-F89 HydrophobicContact CG-CE2 3.83Å; P59-F89 HydrophobicContact CG-CZ 4.05Å; F81-F89 HydrophobicContact CB-CB 4.29Å; F81-F89 HydrophobicContact CB-CD1 3.76Å; F81-F89 HydrophobicContact CB-CE1 4.49Å; F81-F89 HydrophobicContact CB-CG 4.31Å; F81-F89 HydrophobicContact CD1-CB 4.13Å; L82-F89 CarbonylContact O-C 3.5Å; L82-F89 WeakPolarHBondContact O-CA 3.3Å; V83-F89 HydrophobicContact CG2-CD1 3.99Å; V83-F89 HydrophobicContact CG2-CE1 3.69Å
90	H	98.5	Very high	96.9	Very high	37 Å²	37	62.5 Å²	62.5	17%	0.171	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	157.8	163.4	65.4	-91.6	0	0	0	111	F52 V53 D54 L82 N84	F52-H90 HydrophobicContact CE2-CB 3.87Å; F52-H90 AromaticContact CE2-CD2 3.79Å; F52-H90 AromaticContact CE2-CG 3.98Å; F52-H90 HydrophobicContact CZ-CB 4.17Å; V53-H90 CarbonylContact O-C 3.49Å; V53-H90 WeakPolarHBondContact O-CA 3.3Å; V53-H90 VanDerWaalsContact O-CB 3.3Å; V53-H90 WeakPolarHBondContact O-CB 3.3Å; D54-H90 HydrophobicContact CB-CB 4.47Å; L82-H90 VanDerWaalsContact CB-CE1 3.44Å; L82-H90 WeakPolarHBondContact CB-CE1 3.34Å; L82-H90 VanDerWaalsContact CB-NE2 3.27Å; L82-H90 WeakPolarHBondContact CB-NE2 3.19Å; L82-H90 VanDerWaalsContact CD1-NE2 3.31Å; L82-H90 WeakPolarHBondContact CD1-NE2 3.33Å; L82-H90 PolarHBondContact N-O 3.41Å; L82-H90 PolarHBondContact O-N 3.36Å; N84-H90 PolarHBondContact OD1-CE1 3.48Å; N84-H90 PolarHBondContact OD1-ND1 3.04Å
91	K	98.5	Very high	96.6	Very high	27 Å²	27	63 Å²	63	12%	0.117	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	144.6	179	-163.3	-178.5	-170.7	-160.7	0	109.6	V53 I56 I61 I63 E78 T79 F81	V53-K91 PolarHBondContact N-O 2.96Å; V53-K91 PolarHBondContact O-N 3.27Å; I56-K91 HydrophobicContact CD1-CB 3.81Å; I61-K91 HydrophobicContact CG2-CD 4Å; I63-K91 HydrophobicContact CD1-CB 4.35Å; I63-K91 HydrophobicContact CD1-CD 3.97Å; I63-K91 HydrophobicContact CD1-CG 4.35Å; E78-K91 WeakPolarHBondContact OE2-CE 3.43Å; E78-K91 IonicContact OE2-NZ 3.56Å; E78-K91 PolarHBondContact OE2-NZ 3.45Å; T79-K91 WeakPolarHBondContact O-CE 3.38Å; F81-K91 HydrophobicContact CE1-CD 4.22Å
92	L	98.7	Very high	96.3	Very high	29 Å²	29	66.1 Å²	66.1	15%	0.152	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.9	173.9	-63.7	89.1	0	0	0	109.5	I50 C51 F52 E78 T79 L82 Y94	I50-L92 HydrophobicContact CG2-CD2 3.96Å; C51-L92 WeakPolarHBondContact O-CA 3.27Å; F52-L92 HydrophobicContact CD2-CD1 4.3Å; F52-L92 HydrophobicContact CD2-CD2 4.37Å; F52-L92 HydrophobicContact CD2-CG 4.04Å; E78-L92 CarbonylContact C-O 3.58Å; E78-L92 VanDerWaalsContact CA-O 3.3Å; E78-L92 WeakPolarHBondContact CA-O 3.31Å; T79-L92 HydrophobicContact CG2-CB 4.01Å; T79-L92 HydrophobicContact CG2-CD1 4.37Å; T79-L92 PolarHBondContact N-O 3.44Å; T79-L92 PolarHBondContact OG1-N 2.91Å; T79-L92 VanDerWaalsContact OG1-N 3.08Å; L82-L92 HydrophobicContact CD1-CD1 4.06Å; L92-Y94 HydrophobicContact CB-CE2 3.71Å; L92-Y94 WeakPolarHBondContact CD2-OH 3.4Å
93	S	98.8	Very high	96.1	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.2	166.8	-171.7	0	0	0	0	108.8	C51 W65 Y77 E78	C51-S93 PolarHBondContact N-O 3.41Å; C51-S93 PolarHBondContact O-N 3.43Å; W65-S93 PolarHBondContact NE1-OG 2.92Å; Y77-S93 CarbonylContact O-C 3.59Å; Y77-S93 WeakPolarHBondContact O-CA 2.99Å; E78-S93 WeakPolarHBondContact CG-OG 2.9Å; E78-S93 WeakPolarHBondContact OE1-CB 3.04Å; E78-S93 PolarHBondContact OE1-OG 3.31Å
94	Y	98.8	Very high	96	Very high	61 Å²	61	61.5 Å²	61.5	24%	0.239	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.3	-174.2	-58.8	-93.7	0	0	0	109.1	T48 L49 I50 V76 Y77 T79 L92	T48-Y94 HydrophobicContact CG2-CD1 4.11Å; L49-Y94 CarbonylContact O-C 3.58Å; L49-Y94 VanDerWaalsContact O-CA 3.3Å; L49-Y94 WeakPolarHBondContact O-CA 3.43Å; I50-Y94 HydrophobicContact CB-CD1 4.49Å; I50-Y94 HydrophobicContact CD1-CD1 4.36Å; I50-Y94 HydrophobicContact CD1-CE1 4.06Å; I50-Y94 HydrophobicContact CG1-CD1 3.83Å; I50-Y94 HydrophobicContact CG1-CE1 3.97Å; I50-Y94 HydrophobicContact CG2-CD1 4.31Å; I50-Y94 HydrophobicContact CG2-CE1 4.03Å; V76-Y94 WeakPolarHBondContact CA-O 3.44Å; Y77-Y94 AromaticContact CD1-CD2 3.55Å; Y77-Y94 HydrophobicContact CD1-CD2 3.55Å; Y77-Y94 AromaticContact CD1-CE2 3.98Å; Y77-Y94 HydrophobicContact CD1-CE2 3.98Å; Y77-Y94 HydrophobicContact CD1-CG 4.35Å; Y77-Y94 HydrophobicContact CE1-CD2 4.16Å; Y77-Y94 HydrophobicContact CE1-CE2 4.13Å; Y77-Y94 PolarHBondContact N-O 2.92Å; Y77-Y94 WeakPolarHBondContact O-CD2 3.45Å; Y77-Y94 PolarHBondContact O-N 3.29Å; T79-Y94 HydrophobicContact CG2-CE2 3.95Å; L92-Y94 HydrophobicContact CB-CE2 3.71Å; L92-Y94 WeakPolarHBondContact CD2-OH 3.4Å
95	L	98.8	Very high	96.1	Very high	6 Å²	6	60 Å²	60	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	114.6	172.1	172.6	66.8	0	0	0	109.6	T48 L49 W65 V72 V76 Y105	T48-L95 CarbonylContact C-O 3.54Å; T48-L95 VanDerWaalsContact CA-O 3.31Å; T48-L95 WeakPolarHBondContact CA-O 3.43Å; L49-L95 HydrophobicContact CB-CB 4.47Å; L49-L95 PolarHBondContact N-O 3.28Å; L49-L95 PolarHBondContact O-N 3.41Å; W65-L95 HydrophobicContact CB-CD2 4.06Å; W65-L95 HydrophobicContact CD2-CB 3.66Å; W65-L95 HydrophobicContact CD2-CD2 3.9Å; W65-L95 HydrophobicContact CD2-CG 4.38Å; W65-L95 HydrophobicContact CE3-CB 4.14Å; W65-L95 HydrophobicContact CE3-CD2 3.81Å; W65-L95 HydrophobicContact CG-CB 3.92Å; W65-L95 HydrophobicContact CG-CD2 4.03Å; W65-L95 HydrophobicContact CG-CG 4.41Å; W65-L95 HydrophobicContact CZ2-CB 4.11Å; V72-L95 HydrophobicContact CG2-CD1 4Å; V72-L95 HydrophobicContact CG2-CD2 4.08Å; V76-L95 HydrophobicContact CG2-CD1 3.72Å; L95-Y105 HydrophobicContact CD2-CD1 3.61Å; L95-Y105 HydrophobicContact CD2-CE1 3.87Å
96	T	98.4	Very high	96.2	Very high	82 Å²	82	48.9 Å²	48.9	50%	0.503	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.4	170	60.5	0	0	0	0	110.2	G75	G75-T96 VanDerWaalsContact CA-OG1 3.25Å; G75-T96 WeakPolarHBondContact CA-OG1 3.28Å; G75-T96 PolarHBondContact O-N 2.93Å; G75-T96 PolarHBondContact O-OG1 2.84Å
97	F	97.1	Very high	96.5	Very high	15 Å²	15	43.9 Å²	43.9	7%	0.066	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	164.8	-178.3	78.3	-62.6	0	0	0	111.3	N47 L49 P99 Y105 W122	N47-F97 HydrophobicContact CB-CD1 4.32Å; N47-F97 HydrophobicContact CB-CE1 3.71Å; N47-F97 HydrophobicContact CB-CZ 4.23Å; N47-F97 PolarHBondContact N-O 2.85Å; N47-F97 PolarHBondContact O-N 2.9Å; L49-F97 HydrophobicContact CB-CE1 4.46Å; L49-F97 HydrophobicContact CD1-CE1 4.4Å; L49-F97 HydrophobicContact CD1-CZ 4.43Å; L49-F97 HydrophobicContact CD2-CE1 3.98Å; L49-F97 HydrophobicContact CD2-CZ 3.98Å; L49-F97 HydrophobicContact CG-CD1 3.96Å; L49-F97 HydrophobicContact CG-CE1 3.56Å; L49-F97 HydrophobicContact CG-CZ 3.87Å; F97-P99 HydrophobicContact CD2-CB 4.35Å; F97-P99 HydrophobicContact CD2-CG 4.16Å; F97-P99 HydrophobicContact CE1-CG 4.49Å; F97-P99 HydrophobicContact CE2-CB 3.69Å; F97-P99 HydrophobicContact CE2-CG 3.54Å; F97-P99 HydrophobicContact CZ-CB 4.27Å; F97-P99 HydrophobicContact CZ-CG 3.73Å; F97-Y105 HydrophobicContact CB-CE1 4.23Å; F97-Y105 HydrophobicContact CD2-CE1 4.38Å; F97-Y105 AromaticContact CD2-CE2 3.71Å; F97-Y105 HydrophobicContact CD2-CE2 3.71Å; F97-Y105 AromaticContact CD2-CZ 3.58Å; F97-Y105 WeakPolarHBondContact CD2-OH 3.47Å; F97-Y105 HydrophobicContact CE2-CE2 4.03Å; F97-W122 AromaticContact CE2-CH2 3.71Å; F97-W122 HydrophobicContact CE2-CH2 3.71Å; F97-W122 AromaticContact CE2-CZ3 3.64Å; F97-W122 HydrophobicContact CE2-CZ3 3.64Å; F97-W122 AromaticContact CZ-CH2 3.55Å; F97-W122 HydrophobicContact CZ-CH2 3.55Å; F97-W122 HydrophobicContact CZ-CZ2 4.38Å; F97-W122 AromaticContact CZ-CZ3 3.82Å; F97-W122 HydrophobicContact CZ-CZ3 3.82Å
98	I	96.6	Very high	96.8	Very high	100 Å²	100	39.3 Å²	39.3	51%	0.513	20%	0.203	S	C	.	.			trans	-108.9	113.5	167.2	-59	178.6	0	0	0	105.4	S100	I98-S100 PolarHBondContact O-N 2.92Å
99	P	94.6	Very high	97	Very high	3 Å²	3	39 Å²	39	2%	0.019	20%	0.201	C	C	.	.			trans	-59.7	130.5	-177.8	-18.5	28.7	0	0	0	111.6	V41 L43 G44 Q45 N47 F97	V41-P99 HydrophobicContact CG1-CB 3.63Å; V41-P99 HydrophobicContact CG1-CG 3.79Å; L43-P99 HydrophobicContact CD2-CB 4.28Å; G44-P99 PolarHBondContact N-O 2.77Å; Q45-P99 WeakPolarHBondContact O-CD 3.41Å; N47-P99 HydrophobicContact CB-CG 4.21Å; F97-P99 HydrophobicContact CD2-CB 4.35Å; F97-P99 HydrophobicContact CD2-CG 4.16Å; F97-P99 HydrophobicContact CE1-CG 4.49Å; F97-P99 HydrophobicContact CE2-CB 3.69Å; F97-P99 HydrophobicContact CE2-CG 3.54Å; F97-P99 HydrophobicContact CZ-CB 4.27Å; F97-P99 HydrophobicContact CZ-CG 3.73Å
100	S	93.3	Very high	97	Very high	38 Å²	38	40 Å²	40	27%	0.266	21%	0.206	S	C	.	.			trans	-130.2	146.6	172.3	-154.8	0	0	0	0	108.6	I98 D102 D103 P124	I98-S100 PolarHBondContact O-N 2.92Å; S100-D102 VanDerWaalsContact C-N 3.27Å; S100-D102 PolarHBondContact O-N 2.91Å; S100-D103 WeakPolarHBondContact CB-OD2 3.31Å; S100-D103 PolarHBondContact O-N 2.95Å; S100-P124 WeakPolarHBondContact O-CG 3.43Å
101	D	90.5	Very high	97	Very high	100 Å²	100	38.8 Å²	38.8	54%	0.535	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-30.4	173.2	53.7	-16.1	0	0	0	113.8	D103 I126	D101-D103 VanDerWaalsContact C-N 3.34Å; D101-I126 HydrophobicContact CB-CD1 3.39Å
102	D	91.7	Very high	96.8	Very high	131 Å²	131	44.8 Å²	44.8	70%	0.701	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.9	178.6	-65	-38.9	0	0	0	114.5	S100	S100-D102 VanDerWaalsContact C-N 3.27Å; S100-D102 PolarHBondContact O-N 2.91Å
103	D	94.6	Very high	96.6	Very high	14 Å²	14	44.5 Å²	44.5	8%	0.075	23%	0.227	C	C	.	.			trans	-103.3	124.4	-172.6	-73.8	-56.1	0	0	0	112.6	R67 N68 S100 D101 Y105	R67-D103 IonicContact CZ-OD1 3.97Å; R67-D103 IonicContact CZ-OD2 3.42Å; R67-D103 VanDerWaalsContact NE-CG 3.26Å; R67-D103 IonicContact NE-OD1 2.66Å; R67-D103 PolarHBondContact NE-OD1 2.74Å; R67-D103 IonicContact NE-OD2 2.82Å; R67-D103 PolarHBondContact NE-OD2 2.91Å; R67-D103 IonicContact NH2-OD1 2.68Å; R67-D103 PolarHBondContact NH2-OD1 2.8Å; R67-D103 IonicContact NH2-OD2 3.19Å; R67-D103 PolarHBondContact NH2-OD2 2.99Å; N68-D103 PolarHBondContact ND2-OD1 3Å; S100-D103 WeakPolarHBondContact CB-OD2 3.31Å; S100-D103 PolarHBondContact O-N 2.95Å; D101-D103 VanDerWaalsContact C-N 3.34Å; D103-Y105 HydrophobicContact CB-CE2 3.69Å
104	I	96.6	Very high	96.6	Very high	56 Å²	56	46.1 Å²	46.1	29%	0.287	24%	0.235	S	C	.	.			trans	-106.5	147.8	168.3	59.7	167.1	0	0	0	110.9	R67 N68 E123	R67-I104 WeakPolarHBondContact CA-O 3.33Å; N68-I104 PolarHBondContact N-O 3.45Å; N68-I104 VanDerWaalsContact OD1-CG1 3.31Å; N68-I104 WeakPolarHBondContact OD1-CG1 3.31Å; N68-I104 PolarHBondContact OD1-N 2.84Å; I104-E123 HydrophobicContact CG2-CB 4.23Å
105	Y	98.3	Very high	96.4	Very high	3 Å²	3	52.3 Å²	52.3	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.3	-178.5	-61.7	-93.1	0	0	0	110.7	L49 L66 R67 L95 F97 D103 H121 W122	L49-Y105 HydrophobicContact CD1-CD1 4.02Å; L49-Y105 HydrophobicContact CD1-CD2 3.95Å; L49-Y105 HydrophobicContact CD1-CG 3.58Å; L66-Y105 CarbonylContact O-C 3.59Å; L66-Y105 VanDerWaalsContact O-CA 3.27Å; L66-Y105 WeakPolarHBondContact O-CA 3.33Å; R67-Y105 HydrophobicContact CB-CD1 4.1Å; R67-Y105 HydrophobicContact CB-CE1 3.98Å; R67-Y105 HydrophobicContact CG-CD1 4.2Å; R67-Y105 HydrophobicContact CG-CE1 3.73Å; L95-Y105 HydrophobicContact CD2-CD1 3.61Å; L95-Y105 HydrophobicContact CD2-CE1 3.87Å; F97-Y105 HydrophobicContact CB-CE1 4.23Å; F97-Y105 HydrophobicContact CD2-CE1 4.38Å; F97-Y105 AromaticContact CD2-CE2 3.71Å; F97-Y105 HydrophobicContact CD2-CE2 3.71Å; F97-Y105 AromaticContact CD2-CZ 3.58Å; F97-Y105 WeakPolarHBondContact CD2-OH 3.47Å; F97-Y105 HydrophobicContact CE2-CE2 4.03Å; D103-Y105 HydrophobicContact CB-CE2 3.69Å; Y105-H121 CarbonylContact O-C 3.56Å; Y105-W122 AromaticContact CD2-CE3 3.71Å; Y105-W122 HydrophobicContact CD2-CE3 3.71Å; Y105-W122 AromaticContact CD2-CZ3 3.76Å; Y105-W122 HydrophobicContact CD2-CZ3 3.76Å; Y105-W122 HydrophobicContact CE2-CZ3 4.15Å; Y105-W122 HydrophobicContact CG-CE3 4.35Å; Y105-W122 PolarHBondContact N-O 3.35Å; Y105-W122 PolarHBondContact O-N 2.93Å; Y105-W122 VanDerWaalsContact O-O 3.09Å
106	D	98.6	Very high	96.4	Very high	17 Å²	17	59.1 Å²	59.1	9%	0.091	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.3	171.3	-52.2	-72.4	0	0	0	109.8	L66 L119 K120 H121	L66-D106 HydrophobicContact CB-CB 4.15Å; L66-D106 HydrophobicContact CD1-CB 4.26Å; L66-D106 PolarHBondContact N-O 2.96Å; L66-D106 PolarHBondContact O-N 2.83Å; D106-L119 HydrophobicContact CB-CD2 4.13Å; D106-K120 WeakPolarHBondContact CA-O 2.96Å; D106-H121 WeakPolarHBondContact OD1-CA 3.22Å; D106-H121 IonicContact OD1-CE1 3.34Å; D106-H121 IonicContact OD1-CG 3.41Å; D106-H121 IonicContact OD1-ND1 2.62Å; D106-H121 PolarHBondContact OD1-ND1 2.94Å
107	C	98.7	Very high	96.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	112	161.7	178.1	0	0	0	0	108.5	V35 C51 I63 W65 K120	V35-C107 HydrophobicContact CG2-CB 3.48Å; V35-C107 VanDerWaalsContact CG2-CB 3.48Å; C51-C107 HydrophobicContact CB-CB 3.65Å; C51-C107 WeakPolarHBondContact CB-SG 3.04Å; C51-C107 WeakPolarHBondContact SG-CB 3.46Å; C51-C107 CovalentContact SG-SG 2.03Å; C51-C107 PolarHBondContact SG-SG 2.9Å; I63-C107 VanDerWaalsContact CG2-SG 3.6Å; W65-C107 HydrophobicContact CE3-CB 4.33Å; W65-C107 HydrophobicContact CH2-CB 4.27Å; W65-C107 HydrophobicContact CZ3-CB 4.07Å; C107-K120 HydrophobicContact CB-CB 4.37Å; C107-K120 PolarHBondContact N-O 2.92Å; C107-K120 PolarHBondContact O-N 3.47Å
108	K	98.8	Very high	96.4	Very high	54 Å²	54	59.4 Å²	59.4	24%	0.235	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.3	175.4	-176.7	-174.1	174.9	-158	0	109.9	I63 T64 L66 E110 P117 V118 L119	I63-K108 WeakPolarHBondContact CA-O 3.41Å; T64-K108 PolarHBondContact N-O 3.47Å; T64-K108 PolarHBondContact O-N 3.25Å; T64-K108 WeakPolarHBondContact OG1-CB 3.39Å; L66-K108 HydrophobicContact CD1-CB 4.4Å; K108-E110 WeakPolarHBondContact CE-OE1 3.35Å; K108-E110 IonicContact NZ-OE1 2.85Å; K108-E110 PolarHBondContact NZ-OE1 3.08Å; K108-E110 IonicContact NZ-OE2 3.99Å; K108-P117 HydrophobicContact CG-CB 4.19Å; K108-V118 CarbonylContact C-O 3.56Å; K108-V118 WeakPolarHBondContact CA-O 3.07Å; K108-L119 HydrophobicContact CB-CD2 3.5Å; K108-L119 VanDerWaalsContact CB-CD2 3.5Å; K108-L119 HydrophobicContact CD-CD2 4.32Å; K108-L119 HydrophobicContact CG-CD2 3.71Å
109	V	98.7	Very high	96.4	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.7	-179.1	-180	0	0	0	0	109.9	P31 A33 V53 I61 N62 L114 P117 V118	P31-V109 HydrophobicContact CG-CG1 4.26Å; A33-V109 HydrophobicContact CB-CG2 3.87Å; V53-V109 HydrophobicContact CG1-CG1 4.11Å; V53-V109 HydrophobicContact CG2-CG2 3.88Å; I61-V109 HydrophobicContact CD1-CG1 3.58Å; I61-V109 HydrophobicContact CG1-CG1 3.94Å; N62-V109 WeakPolarHBondContact O-CA 3.3Å; V109-L114 HydrophobicContact CG1-CD1 4.45Å; V109-P117 CarbonylContact O-C 3.49Å; V109-P117 WeakPolarHBondContact O-CA 3.43Å; V109-V118 PolarHBondContact N-O 2.86Å; V109-V118 PolarHBondContact O-N 3.27Å
110	E	98.6	Very high	96.6	Very high	65 Å²	65	62.2 Å²	62.2	30%	0.304	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	128.5	175.8	-53.3	175	128.4	0	0	109.4	I61 N62 K108 P117	I61-E110 VanDerWaalsContact CG1-O 3.31Å; I61-E110 WeakPolarHBondContact CG1-O 3.16Å; N62-E110 HydrophobicContact CB-CB 4.17Å; N62-E110 PolarHBondContact N-O 3.42Å; N62-E110 PolarHBondContact ND2-OE2 2.99Å; N62-E110 PolarHBondContact O-N 3.11Å; K108-E110 WeakPolarHBondContact CE-OE1 3.35Å; K108-E110 IonicContact NZ-OE1 2.85Å; K108-E110 PolarHBondContact NZ-OE1 3.08Å; K108-E110 IonicContact NZ-OE2 3.99Å; E110-P117 HydrophobicContact CG-CB 3.88Å; E110-P117 HydrophobicContact CG-CG 3.95Å
111	H	97.9	Very high	96.9	Very high	13 Å²	13	65 Å²	65	6%	0.06	32%	0.323	C	S	.	.			trans	-155.4	152.6	-176.5	-175.6	-86.6	0	0	0	108.9	E29 P31 F57 P58 V60 I61 G113 L114	E29-H111 PolarHBondContact O-CE1 2.81Å; E29-H111 PolarHBondContact O-ND1 2.77Å; P31-H111 HydrophobicContact CG-CB 3.63Å; F57-H111 PolarHBondContact O-CE1 2.03Å; F57-H111 PolarHBondContact O-NE2 2.91Å; P58-H111 PolarHBondContact O-NE2 2.86Å; P58-H111 VanDerWaalsContact O-NE2 3.08Å; V60-H111 PolarHBondContact O-CD2 3Å; I61-H111 HydrophobicContact CD1-CB 4.48Å; I61-H111 HydrophobicContact CG1-CB 4.19Å; H111-G113 VanDerWaalsContact C-N 3.33Å; H111-G113 PolarHBondContact ND1-N 2.87Å; H111-G113 PolarHBondContact O-N 3.04Å; H111-L114 HydrophobicContact CB-CD1 4.13Å; H111-L114 HydrophobicContact CB-CG 4.29Å; H111-L114 PolarHBondContact O-N 2.68Å; H111-L114 VanDerWaalsContact O-N 3.14Å
112	W	95	Very high	97.2	Very high	152 Å²	152	61.7 Å²	61.7	58%	0.576	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-31.5	-176.5	-56.6	-34.4	0	0	0	113.6	E28 P58 V60 L114	E28-W112 VanDerWaalsContact CD-CB 3.45Å; E28-W112 HydrophobicContact CG-CB 4.34Å; E28-W112 WeakPolarHBondContact OE1-CB 3.4Å; E28-W112 VanDerWaalsContact OE2-C 3.3Å; E28-W112 WeakPolarHBondContact OE2-CB 3.3Å; P58-W112 HydrophobicContact CG-CE3 3.56Å; P58-W112 HydrophobicContact CG-CZ3 3.58Å; V60-W112 HydrophobicContact CB-CH2 4.12Å; V60-W112 HydrophobicContact CB-CZ2 4.36Å; V60-W112 HydrophobicContact CB-CZ3 4.38Å; V60-W112 HydrophobicContact CG1-CH2 4.07Å; V60-W112 HydrophobicContact CG1-CZ2 3.88Å; V60-W112 HydrophobicContact CG2-CH2 4.05Å; V60-W112 HydrophobicContact CG2-CZ3 4.36Å; W112-L114 PolarHBondContact O-N 2.66Å
113	G	95.1	Very high	97.3	Very high	24 Å²	24	60.8 Å²	60.8	25%	0.247	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	3.9	172.4	0	0	0	0	0	114.5	A30 H111	A30-G113 WeakPolarHBondContact CB-O 3.27Å; H111-G113 VanDerWaalsContact C-N 3.33Å; H111-G113 PolarHBondContact ND1-N 2.87Å; H111-G113 PolarHBondContact O-N 3.04Å
114	L	97.1	Very high	97.2	Very high	33 Å²	33	60.8 Å²	60.8	17%	0.173	30%	0.295	C	S	.	.			trans	-114.3	128.4	174	-59.3	172.5	0	0	0	110.3	A30 P31 V109 H111 W112 E116 V118	A30-L114 HydrophobicContact CB-CD2 4.01Å; P31-L114 HydrophobicContact CG-CD1 3.95Å; P31-L114 HydrophobicContact CG-CG 4.19Å; V109-L114 HydrophobicContact CG1-CD1 4.45Å; H111-L114 HydrophobicContact CB-CD1 4.13Å; H111-L114 HydrophobicContact CB-CG 4.29Å; H111-L114 PolarHBondContact O-N 2.68Å; H111-L114 VanDerWaalsContact O-N 3.14Å; W112-L114 PolarHBondContact O-N 2.66Å; L114-E116 VanDerWaalsContact C-N 3.27Å; L114-E116 WeakPolarHBondContact CB-O 3.44Å; L114-E116 PolarHBondContact O-N 2.96Å; L114-V118 HydrophobicContact CD1-CB 4.25Å; L114-V118 HydrophobicContact CD1-CG2 3.77Å; L114-V118 HydrophobicContact CD2-CG2 3.87Å; L114-V118 HydrophobicContact CG-CG2 4.42Å
115	E	96.3	Very high	96.5	Very high	191 Å²	191	67.2 Å²	67.2	89%	0.893	32%	0.324	S	S	*	.	S	Bend	trans	-63.4	-37.1	171.7	-174.8	65.9	-169.7	0	0	111.6
116	E	97.6	Very high	95.3	Very high	149 Å²	149	70.7 Å²	70.7	70%	0.696	34%	0.342	S	S	*	.	S	Bend	trans	-135.7	151.4	178.9	-65.4	-175.7	179.1	0	0	110.9	L114 V118	L114-E116 VanDerWaalsContact C-N 3.27Å; L114-E116 WeakPolarHBondContact CB-O 3.44Å; L114-E116 PolarHBondContact O-N 2.96Å; E116-V118 PolarHBondContact O-N 2.87Å
117	P	97.9	Very high	93.7	Very high	63 Å²	63	75.5 Å²	75.5	41%	0.409	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-56.1	132.3	175.1	-25.3	34.9	0	0	0	112.4	K108 V109 E110	K108-P117 HydrophobicContact CG-CB 4.19Å; V109-P117 CarbonylContact O-C 3.49Å; V109-P117 WeakPolarHBondContact O-CA 3.43Å; E110-P117 HydrophobicContact CG-CB 3.88Å; E110-P117 HydrophobicContact CG-CG 3.95Å
118	V	97.5	Very high	91.9	Very high	40 Å²	40	79.1 Å²	79.1	24%	0.242	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.1	175.2	169.5	0	0	0	0	109.3	K108 V109 L114 E116 K120	K108-V118 CarbonylContact C-O 3.56Å; K108-V118 WeakPolarHBondContact CA-O 3.07Å; V109-V118 PolarHBondContact N-O 2.86Å; V109-V118 PolarHBondContact O-N 3.27Å; L114-V118 HydrophobicContact CD1-CB 4.25Å; L114-V118 HydrophobicContact CD1-CG2 3.77Å; L114-V118 HydrophobicContact CD2-CG2 3.87Å; L114-V118 HydrophobicContact CG-CG2 4.42Å; E116-V118 PolarHBondContact O-N 2.87Å; V118-K120 HydrophobicContact CG1-CD 4.21Å; V118-K120 VanDerWaalsContact CG1-CE 3.46Å; V118-K120 HydrophobicContact CG1-CG 4.1Å
119	L	98.2	Very high	90	Very high	96 Å²	96	82.1 Å²	82.1	50%	0.503	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.4	170.5	-69.4	169.5	0	0	0	109.5	L66 D106 K108	L66-L119 HydrophobicContact CD1-CD2 3.8Å; D106-L119 HydrophobicContact CB-CD2 4.13Å; K108-L119 HydrophobicContact CB-CD2 3.5Å; K108-L119 VanDerWaalsContact CB-CD2 3.5Å; K108-L119 HydrophobicContact CD-CD2 4.32Å; K108-L119 HydrophobicContact CG-CD2 3.71Å
120	K	98.4	Very high	87.6	Confident	66 Å²	66	88.9 Å²	88.9	29%	0.287	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	102.9	170.9	-66.1	-65.6	171.4	156	0	109.4	A33 V35 D106 C107 V118	A33-K120 HydrophobicContact CB-CD 4.39Å; A33-K120 HydrophobicContact CB-CG 3.53Å; A33-K120 VanDerWaalsContact O-CD 3.22Å; A33-K120 WeakPolarHBondContact O-CD 3.46Å; A33-K120 WeakPolarHBondContact O-CE 3.33Å; A33-K120 WeakPolarHBondContact O-CG 3.26Å; A33-K120 PolarHBondContact O-NZ 3.08Å; A33-K120 VanDerWaalsContact O-NZ 3.13Å; V35-K120 HydrophobicContact CG2-CB 3.58Å; D106-K120 WeakPolarHBondContact CA-O 2.96Å; C107-K120 HydrophobicContact CB-CB 4.37Å; C107-K120 PolarHBondContact N-O 2.92Å; C107-K120 PolarHBondContact O-N 3.47Å; V118-K120 HydrophobicContact CG1-CD 4.21Å; V118-K120 VanDerWaalsContact CG1-CE 3.46Å; V118-K120 HydrophobicContact CG1-CG 4.1Å
121	H	98.1	Very high	85.6	Confident	98 Å²	98	88.5 Å²	88.5	45%	0.454	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	143.1	178.5	-170.7	70.6	0	0	0	111.7	Y105 D106	Y105-H121 CarbonylContact O-C 3.56Å; D106-H121 WeakPolarHBondContact OD1-CA 3.22Å; D106-H121 IonicContact OD1-CE1 3.34Å; D106-H121 IonicContact OD1-CG 3.41Å; D106-H121 IonicContact OD1-ND1 2.62Å; D106-H121 PolarHBondContact OD1-ND1 2.94Å
122	W	97.5	Very high	83.8	Confident	30 Å²	30	95.1 Å²	95.1	11%	0.114	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	132.7	171.6	-176.6	89.3	0	0	0	109.9	V35 P37 V41 L49 F97 Y105 P124	V35-W122 HydrophobicContact CB-CB 4.27Å; V35-W122 HydrophobicContact CG1-CB 3.62Å; V35-W122 HydrophobicContact CG1-CG 3.9Å; P37-W122 HydrophobicContact CB-CZ2 4.42Å; P37-W122 HydrophobicContact CG-CZ2 4.46Å; V41-W122 HydrophobicContact CG1-CH2 4.39Å; V41-W122 HydrophobicContact CG2-CH2 4.17Å; V41-W122 HydrophobicContact CG2-CZ2 3.77Å; L49-W122 HydrophobicContact CD1-CD2 4.07Å; L49-W122 HydrophobicContact CD1-CE3 3.61Å; L49-W122 HydrophobicContact CD1-CZ3 4.05Å; L49-W122 HydrophobicContact CD2-CD2 3.44Å; L49-W122 VanDerWaalsContact CD2-CD2 3.44Å; L49-W122 HydrophobicContact CD2-CE3 3.68Å; L49-W122 HydrophobicContact CD2-CG 3.99Å; L49-W122 HydrophobicContact CD2-CH2 4Å; L49-W122 HydrophobicContact CD2-CZ2 3.78Å; L49-W122 HydrophobicContact CD2-CZ3 3.95Å; L49-W122 HydrophobicContact CG-CD2 4.41Å; L49-W122 HydrophobicContact CG-CE3 4.24Å; L49-W122 HydrophobicContact CG-CZ3 4.45Å; F97-W122 AromaticContact CE2-CH2 3.71Å; F97-W122 HydrophobicContact CE2-CH2 3.71Å; F97-W122 AromaticContact CE2-CZ3 3.64Å; F97-W122 HydrophobicContact CE2-CZ3 3.64Å; F97-W122 AromaticContact CZ-CH2 3.55Å; F97-W122 HydrophobicContact CZ-CH2 3.55Å; F97-W122 HydrophobicContact CZ-CZ2 4.38Å; F97-W122 AromaticContact CZ-CZ3 3.82Å; F97-W122 HydrophobicContact CZ-CZ3 3.82Å; Y105-W122 AromaticContact CD2-CE3 3.71Å; Y105-W122 HydrophobicContact CD2-CE3 3.71Å; Y105-W122 AromaticContact CD2-CZ3 3.76Å; Y105-W122 HydrophobicContact CD2-CZ3 3.76Å; Y105-W122 HydrophobicContact CE2-CZ3 4.15Å; Y105-W122 HydrophobicContact CG-CE3 4.35Å; Y105-W122 PolarHBondContact N-O 3.35Å; Y105-W122 PolarHBondContact O-N 2.93Å; Y105-W122 VanDerWaalsContact O-O 3.09Å; W122-P124 HydrophobicContact CH2-CB 4.16Å; W122-P124 HydrophobicContact CH2-CG 3.79Å; W122-P124 HydrophobicContact CZ3-CG 3.81Å
123	E	94.8	Very high	82.2	Confident	112 Å²	112	93.6 Å²	93.6	52%	0.523	50%	0.5	S	S	.	.			trans	-132.1	152.3	171.2	62.5	-178.8	178.8	0	0	109.2	I104 E125	I104-E123 HydrophobicContact CG2-CB 4.23Å; E123-E125 PolarHBondContact O-N 2.89Å
124	P	90.6	Very high	80.8	Confident	14 Å²	14	95.8 Å²	95.8	9%	0.091	51%	0.509	C	S	.	.			trans	-62.1	118.7	172.2	-18.5	30.9	0	0	0	110.4	V41 S100 W122 I126	V41-P124 HydrophobicContact CG1-CB 4.25Å; S100-P124 WeakPolarHBondContact O-CG 3.43Å; W122-P124 HydrophobicContact CH2-CB 4.16Å; W122-P124 HydrophobicContact CH2-CG 3.79Å; W122-P124 HydrophobicContact CZ3-CG 3.81Å; P124-I126 VanDerWaalsContact C-N 3.3Å; P124-I126 HydrophobicContact CB-CG1 4.28Å; P124-I126 PolarHBondContact O-N 2.95Å
125	E	83.8	Confident	79.7	Confident	190 Å²	190	99.9 Å²	99.9	89%	0.888	53%	0.527	S	S	*	.			trans	-70.5	89.3	168	-69.9	-179	-165.5	0	0	109.1	E123	E123-E125 PolarHBondContact O-N 2.89Å
126	I	71.6	Confident	78.9	Confident	77 Å²	77	94.6 Å²	94.6	40%	0.395	51%	0.508	S	S	.	.			trans	-80.9	123.9	172.5	-58	170.4	0	0	0	106.5	L43 D101 P124 A128	L43-I126 HydrophobicContact CD1-CD1 4.25Å; L43-I126 HydrophobicContact CD2-CD1 4.4Å; D101-I126 HydrophobicContact CB-CD1 3.39Å; P124-I126 VanDerWaalsContact C-N 3.3Å; P124-I126 HydrophobicContact CB-CG1 4.28Å; P124-I126 PolarHBondContact O-N 2.95Å; I126-A128 PolarHBondContact O-N 2.84Å
127	P	65.5	Low	78.2	Confident	117 Å²	117	91.2 Å²	91.2	76%	0.76	50%	0.497	S	S	*	.			trans	-54.3	114	166.8	-18.9	29.8	0	0	0	106.7	P129	P127-P129 VanDerWaalsContact O-N 3.14Å
128	A	60.1	Low	77.7	Confident	77 Å²	77	93.1 Å²	93.1	64%	0.636	51%	0.508	S	S	*	.			trans	-48	130	177.7	0	0	0	0	0	107.1	I126 M130	I126-A128 PolarHBondContact O-N 2.84Å; A128-M130 VanDerWaalsContact C-N 3.33Å; A128-M130 PolarHBondContact O-N 3.13Å
129	P	59.3	Low	77.2	Confident	116 Å²	116	94.7 Å²	94.7	75%	0.753	52%	0.52	S	S	*	.			trans	-55.3	112.1	169	23.9	-30.4	0	0	0	104	P127 S131	P127-P129 VanDerWaalsContact O-N 3.14Å; P129-S131 VanDerWaalsContact C-N 3.29Å; P129-S131 PolarHBondContact O-N 2.86Å
130	M	49.6	Very low	76.8	Confident	143 Å²	143	92.8 Å²	92.8	70%	0.704	52%	0.518	S	S	*	.			trans	-54.2	108.6	174	-73.4	-166.3	61.3	0	0	104.1	A128 E132	A128-M130 VanDerWaalsContact C-N 3.33Å; A128-M130 PolarHBondContact O-N 3.13Å; M130-E132 PolarHBondContact O-N 2.88Å
131	S	54.9	Low	76.6	Confident	57 Å²	57	94.8 Å²	94.8	40%	0.399	53%	0.531	S	S	.	.			trans	-56.3	119.4	-174.8	177.5	0	0	0	0	105.4	P129 L133 T134	P129-S131 VanDerWaalsContact C-N 3.29Å; P129-S131 PolarHBondContact O-N 2.86Å; S131-L133 PolarHBondContact O-N 2.85Å; S131-T134 PolarHBondContact O-N 3.47Å; S131-T134 PolarHBondContact O-OG1 2.72Å
132	E	60.9	Low	76.3	Confident	153 Å²	153	92.3 Å²	92.3	72%	0.715	53%	0.532	S	S	*	.	H	α-helix	trans	-45.6	-27	177.5	-67.7	-92.8	141.8	0	0	111.4	M130 T136	M130-E132 PolarHBondContact O-N 2.88Å; E132-T136 WeakPolarHBondContact O-CB 3.22Å; E132-T136 VanDerWaalsContact O-CG2 3.26Å; E132-T136 WeakPolarHBondContact O-CG2 3.36Å; E132-T136 PolarHBondContact O-N 2.88Å; E132-T136 VanDerWaalsContact O-N 3.09Å; E132-T136 PolarHBondContact O-OG1 2.86Å
133	L	61.5	Low	76.2	Confident	119 Å²	119	97 Å²	97	62%	0.623	56%	0.559	S	S	*	*	H	α-helix	trans	-64.4	-36.6	174.8	-61.2	170.7	0	0	0	113.5	S131 T136 V137	S131-L133 PolarHBondContact O-N 2.85Å; L133-T136 VanDerWaalsContact CA-OG1 3.31Å; L133-T136 WeakPolarHBondContact CA-OG1 3.41Å; L133-T136 PolarHBondContact O-OG1 3.14Å; L133-T136 VanDerWaalsContact O-OG1 3.06Å; L133-V137 VanDerWaalsContact O-CB 3.22Å; L133-V137 WeakPolarHBondContact O-CB 3.38Å; L133-V137 WeakPolarHBondContact O-CG2 3.33Å; L133-V137 PolarHBondContact O-N 3.44Å
134	T	66.1	Low	76.2	Confident	71 Å²	71	94.5 Å²	94.5	44%	0.436	55%	0.554	S	S	.	*	H	α-helix	trans	-72.4	-40.3	-179.8	59.4	0	0	0	0	111.7	S131 V138	S131-T134 PolarHBondContact O-N 3.47Å; S131-T134 PolarHBondContact O-OG1 2.72Å; T134-V138 WeakPolarHBondContact O-CB 3.16Å; T134-V138 WeakPolarHBondContact O-CG2 3.46Å; T134-V138 PolarHBondContact O-N 3.12Å
135	E	73.4	Confident	76.5	Confident	119 Å²	119	98.9 Å²	98.9	56%	0.556	58%	0.58	S	S	*	*	H	α-helix	trans	-68.4	-45	176.9	-166.1	176.4	169.9	0	0	111.3	V137 V138 C139	E135-V137 PolarHBondContact O-N 3Å; E135-V138 PolarHBondContact O-N 3.14Å; E135-C139 WeakPolarHBondContact O-CB 3.36Å; E135-C139 PolarHBondContact O-N 2.92Å
136	T	78.8	Confident	77	Confident	79 Å²	79	91.6 Å²	91.6	49%	0.485	56%	0.556	S	S	.	*	H	α-helix	trans	-63.7	-39.8	176.7	51.3	0	0	0	0	112.9	E132 L133 A140	E132-T136 WeakPolarHBondContact O-CB 3.22Å; E132-T136 VanDerWaalsContact O-CG2 3.26Å; E132-T136 WeakPolarHBondContact O-CG2 3.36Å; E132-T136 PolarHBondContact O-N 2.88Å; E132-T136 VanDerWaalsContact O-N 3.09Å; E132-T136 PolarHBondContact O-OG1 2.86Å; L133-T136 VanDerWaalsContact CA-OG1 3.31Å; L133-T136 WeakPolarHBondContact CA-OG1 3.41Å; L133-T136 PolarHBondContact O-OG1 3.14Å; L133-T136 VanDerWaalsContact O-OG1 3.06Å; T136-A140 VanDerWaalsContact O-CB 3.27Å; T136-A140 WeakPolarHBondContact O-CB 3.22Å; T136-A140 PolarHBondContact O-N 3.46Å
137	V	84	Confident	78.2	Confident	78 Å²	78	93.4 Å²	93.4	47%	0.473	57%	0.566	S	S	.	*	H	α-helix	trans	-66.5	-44.4	176.2	168.8	0	0	0	0	111.1	L133 E135 C139 A140 L141	L133-V137 VanDerWaalsContact O-CB 3.22Å; L133-V137 WeakPolarHBondContact O-CB 3.38Å; L133-V137 WeakPolarHBondContact O-CG2 3.33Å; L133-V137 PolarHBondContact O-N 3.44Å; E135-V137 PolarHBondContact O-N 3Å; V137-C139 PolarHBondContact O-N 3.48Å; V137-A140 PolarHBondContact O-N 3.08Å; V137-L141 HydrophobicContact CG1-CD1 3.74Å; V137-L141 HydrophobicContact CG1-CG 4.23Å; V137-L141 WeakPolarHBondContact O-CB 3.1Å; V137-L141 VanDerWaalsContact O-CG 3.23Å; V137-L141 WeakPolarHBondContact O-CG 3.42Å; V137-L141 PolarHBondContact O-N 3.35Å
138	V	87.4	Confident	79.7	Confident	103 Å²	103	92.3 Å²	92.3	62%	0.624	56%	0.557	S	S	*	*	H	α-helix	trans	-62.1	-44.3	177.4	170.7	0	0	0	0	110.8	T134 E135 G142	T134-V138 WeakPolarHBondContact O-CB 3.16Å; T134-V138 WeakPolarHBondContact O-CG2 3.46Å; T134-V138 PolarHBondContact O-N 3.12Å; E135-V138 PolarHBondContact O-N 3.14Å; V138-G142 PolarHBondContact O-N 2.86Å
139	C	87.4	Confident	81.3	Confident	73 Å²	73	90.8 Å²	90.8	49%	0.493	55%	0.548	S	S	.	.	H	α-helix	trans	-62.6	-45.6	174.9	-83.6	0	0	0	0	112.6	E135 V137 G142 L143	E135-C139 WeakPolarHBondContact O-CB 3.36Å; E135-C139 PolarHBondContact O-N 2.92Å; V137-C139 PolarHBondContact O-N 3.48Å; C139-G142 PolarHBondContact O-N 3.47Å; C139-L143 WeakPolarHBondContact O-CB 3.13Å; C139-L143 VanDerWaalsContact O-CG 3.27Å; C139-L143 WeakPolarHBondContact O-CG 3.36Å; C139-L143 PolarHBondContact O-N 3.33Å
140	A	90.1	Very high	83.1	Confident	57 Å²	57	90.6 Å²	90.6	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-64.1	-43.2	-179.9	0	0	0	0	0	112.1	T136 V137 L143 S144	T136-A140 VanDerWaalsContact O-CB 3.27Å; T136-A140 WeakPolarHBondContact O-CB 3.22Å; T136-A140 PolarHBondContact O-N 3.46Å; V137-A140 PolarHBondContact O-N 3.08Å; A140-L143 PolarHBondContact O-N 2.81Å; A140-S144 PolarHBondContact O-N 2.86Å; A140-S144 PolarHBondContact O-OG 3.27Å
141	L	92.5	Very high	85.3	Confident	107 Å²	107	87.3 Å²	87.3	56%	0.56	53%	0.527	S	S	*	.	H	α-helix	trans	-64	-45.5	175.2	-68.9	175.3	0	0	0	110.7	V137 L143 S144 V145	V137-L141 HydrophobicContact CG1-CD1 3.74Å; V137-L141 HydrophobicContact CG1-CG 4.23Å; V137-L141 WeakPolarHBondContact O-CB 3.1Å; V137-L141 VanDerWaalsContact O-CG 3.23Å; V137-L141 WeakPolarHBondContact O-CG 3.42Å; V137-L141 PolarHBondContact O-N 3.35Å; L141-L143 PolarHBondContact O-N 2.63Å; L141-S144 PolarHBondContact O-N 2.85Å; L141-S144 PolarHBondContact O-OG 3.37Å; L141-V145 WeakPolarHBondContact O-CG2 3.39Å; L141-V145 PolarHBondContact O-N 3.06Å
142	G	93.3	Very high	87.2	Confident	46 Å²	46	87.7 Å²	87.7	47%	0.474	53%	0.527	S	S	.	.	H	α-helix	trans	-59	-44.7	176.4	0	0	0	0	0	113.1	V138 C139 G146	V138-G142 PolarHBondContact O-N 2.86Å; C139-G142 PolarHBondContact O-N 3.47Å; G142-G146 PolarHBondContact O-N 2.94Å
143	L	95.4	Very high	88.8	Confident	129 Å²	129	81.9 Å²	81.9	68%	0.675	51%	0.509	S	S	*	.	H	α-helix	trans	-63.9	-44.7	177.2	-74.2	172	0	0	0	112	C139 A140 L141 G146 L147	C139-L143 WeakPolarHBondContact O-CB 3.13Å; C139-L143 VanDerWaalsContact O-CG 3.27Å; C139-L143 WeakPolarHBondContact O-CG 3.36Å; C139-L143 PolarHBondContact O-N 3.33Å; A140-L143 PolarHBondContact O-N 2.81Å; L141-L143 PolarHBondContact O-N 2.63Å; L143-G146 PolarHBondContact O-N 2.88Å; L143-L147 WeakPolarHBondContact O-CB 3.02Å; L143-L147 PolarHBondContact O-N 2.72Å
144	S	94.5	Very high	90.3	Very high	60 Å²	60	79.5 Å²	79.5	42%	0.42	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-45.3	179.5	68.4	0	0	0	0	112.2	A140 L141 L147 V148	A140-S144 PolarHBondContact O-N 2.86Å; A140-S144 PolarHBondContact O-OG 3.27Å; L141-S144 PolarHBondContact O-N 2.85Å; L141-S144 PolarHBondContact O-OG 3.37Å; S144-L147 PolarHBondContact O-N 3.01Å; S144-V148 VanDerWaalsContact O-CG2 3.3Å; S144-V148 WeakPolarHBondContact O-CG2 3.44Å; S144-V148 PolarHBondContact O-N 2.87Å
145	V	95.9	Very high	91.6	Very high	105 Å²	105	80 Å²	80	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-64.9	-42.7	177.5	174.5	0	0	0	0	110.9	L141 L147 V148 G149	L141-V145 WeakPolarHBondContact O-CG2 3.39Å; L141-V145 PolarHBondContact O-N 3.06Å; V145-L147 PolarHBondContact O-N 3.26Å; V145-V148 PolarHBondContact O-N 3.04Å; V145-G149 PolarHBondContact O-N 3.13Å
146	G	95.3	Very high	92.4	Very high	37 Å²	37	81.1 Å²	81.1	38%	0.381	50%	0.501	S	S	.	.	H	α-helix	trans	-60.2	-44.6	176.7	0	0	0	0	0	112.7	G142 L143 G149 I150	G142-G146 PolarHBondContact O-N 2.94Å; L143-G146 PolarHBondContact O-N 2.88Å; G146-G149 PolarHBondContact O-N 2.98Å; G146-I150 WeakPolarHBondContact O-CG1 3.43Å; G146-I150 PolarHBondContact O-N 2.84Å
147	L	96	Very high	93	Very high	116 Å²	116	82.6 Å²	82.6	61%	0.607	51%	0.505	S	S	*	.	H	α-helix	trans	-67	-42.8	-179	-144.9	158.5	0	0	0	111.4	L143 S144 V145 G149 I150 V151	L143-L147 WeakPolarHBondContact O-CB 3.02Å; L143-L147 PolarHBondContact O-N 2.72Å; S144-L147 PolarHBondContact O-N 3.01Å; V145-L147 PolarHBondContact O-N 3.26Å; L147-G149 VanDerWaalsContact C-N 3.34Å; L147-G149 PolarHBondContact O-N 3.06Å; L147-I150 PolarHBondContact O-N 2.97Å; L147-V151 HydrophobicContact CD2-CG2 4.19Å; L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 3.18Å
148	V	96.4	Very high	93.3	Very high	94 Å²	94	82.8 Å²	82.8	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-60.7	-44	173.5	173.4	0	0	0	0	110.9	S144 V145 I150 V151 V152	S144-V148 VanDerWaalsContact O-CG2 3.3Å; S144-V148 WeakPolarHBondContact O-CG2 3.44Å; S144-V148 PolarHBondContact O-N 2.87Å; V145-V148 PolarHBondContact O-N 3.04Å; V148-I150 VanDerWaalsContact C-N 3.34Å; V148-I150 PolarHBondContact O-N 3.33Å; V148-V151 PolarHBondContact O-N 3.33Å; V148-V152 HydrophobicContact CG1-CG2 4.23Å; V148-V152 VanDerWaalsContact O-CG2 3.3Å; V148-V152 WeakPolarHBondContact O-CG2 3.34Å; V148-V152 PolarHBondContact O-N 3.34Å
149	G	95.7	Very high	92.9	Very high	44 Å²	44	83 Å²	83	45%	0.454	50%	0.497	S	S	.	.	H	α-helix	trans	-59	-41.4	176.7	0	0	0	0	0	113.2	V145 G146 L147 G153	V145-G149 PolarHBondContact O-N 3.13Å; G146-G149 PolarHBondContact O-N 2.98Å; L147-G149 VanDerWaalsContact C-N 3.34Å; L147-G149 PolarHBondContact O-N 3.06Å; G149-G153 PolarHBondContact O-N 3.27Å
150	I	96.1	Very high	92.5	Very high	113 Å²	113	81.8 Å²	81.8	58%	0.579	50%	0.497	S	S	*	.	H	α-helix	trans	-64.7	-46.6	176.2	-68	165	0	0	0	111	G146 L147 V148 G153 T154	G146-I150 WeakPolarHBondContact O-CG1 3.43Å; G146-I150 PolarHBondContact O-N 2.84Å; L147-I150 PolarHBondContact O-N 2.97Å; V148-I150 VanDerWaalsContact C-N 3.34Å; V148-I150 PolarHBondContact O-N 3.33Å; I150-G153 PolarHBondContact O-N 3.2Å; I150-T154 HydrophobicContact CG2-CG2 4.37Å; I150-T154 WeakPolarHBondContact O-CB 3.32Å; I150-T154 VanDerWaalsContact O-CG2 3.27Å; I150-T154 WeakPolarHBondContact O-CG2 3.47Å; I150-T154 PolarHBondContact O-N 3.48Å; I150-T154 PolarHBondContact O-OG1 2.92Å
151	V	95.7	Very high	91.7	Very high	73 Å²	73	85.2 Å²	85.2	44%	0.442	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-48.8	179.9	173.7	0	0	0	0	110.6	L147 V148 T154 I155	L147-V151 HydrophobicContact CD2-CG2 4.19Å; L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 3.18Å; V148-V151 PolarHBondContact O-N 3.33Å; V151-T154 PolarHBondContact O-N 3Å; V151-T154 PolarHBondContact O-OG1 2.89Å; V151-I155 HydrophobicContact CG1-CD1 4.04Å; V151-I155 VanDerWaalsContact O-CG1 3.3Å; V151-I155 WeakPolarHBondContact O-CG1 3.43Å; V151-I155 PolarHBondContact O-N 3.34Å; V151-I155 VanDerWaalsContact O-N 3.16Å
152	V	95	Very high	90.6	Very high	66 Å²	66	89.4 Å²	89.4	40%	0.4	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-45.2	178.8	175.6	0	0	0	0	110.9	V148 T154 I155 F156	V148-V152 HydrophobicContact CG1-CG2 4.23Å; V148-V152 VanDerWaalsContact O-CG2 3.3Å; V148-V152 WeakPolarHBondContact O-CG2 3.34Å; V148-V152 PolarHBondContact O-N 3.34Å; V152-T154 PolarHBondContact O-N 3Å; V152-I155 PolarHBondContact O-N 3.49Å; V152-F156 HydrophobicContact CG1-CD2 3.64Å; V152-F156 HydrophobicContact CG1-CE2 3.55Å; V152-F156 VanDerWaalsContact O-CD2 3.3Å; V152-F156 WeakPolarHBondContact O-CD2 3.43Å; V152-F156 PolarHBondContact O-N 2.9Å
153	G	93.4	Very high	89	Confident	31 Å²	31	92.4 Å²	92.4	32%	0.32	53%	0.528	S	S	.	.	H	α-helix	trans	-60.4	-44	179	0	0	0	0	0	113.2	G149 I150 I155 F156 I157	G149-G153 PolarHBondContact O-N 3.27Å; I150-G153 PolarHBondContact O-N 3.2Å; G153-I155 PolarHBondContact O-N 3.03Å; G153-F156 PolarHBondContact O-N 3.48Å; G153-I157 WeakPolarHBondContact O-CG1 3.19Å; G153-I157 PolarHBondContact O-N 2.8Å
154	T	94.2	Very high	87.3	Confident	68 Å²	68	89.6 Å²	89.6	42%	0.417	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-39.6	177.1	54.1	0	0	0	0	112.2	I150 V151 V152 I157 I158	I150-T154 HydrophobicContact CG2-CG2 4.37Å; I150-T154 WeakPolarHBondContact O-CB 3.32Å; I150-T154 VanDerWaalsContact O-CG2 3.27Å; I150-T154 WeakPolarHBondContact O-CG2 3.47Å; I150-T154 PolarHBondContact O-N 3.48Å; I150-T154 PolarHBondContact O-OG1 2.92Å; V151-T154 PolarHBondContact O-N 3Å; V151-T154 PolarHBondContact O-OG1 2.89Å; V152-T154 PolarHBondContact O-N 3Å; T154-I157 PolarHBondContact O-N 3.03Å; T154-I158 VanDerWaalsContact O-CG1 3.27Å; T154-I158 WeakPolarHBondContact O-CG1 3.5Å; T154-I158 PolarHBondContact O-N 3.48Å
155	I	92.6	Very high	85.6	Confident	81 Å²	81	89.4 Å²	89.4	42%	0.415	54%	0.538	S	S	.	.	H	α-helix	trans	-61.5	-47.7	175.4	-68.3	168.4	0	0	0	110.9	V151 V152 G153 I157 I158 Q159	V151-I155 HydrophobicContact CG1-CD1 4.04Å; V151-I155 VanDerWaalsContact O-CG1 3.3Å; V151-I155 WeakPolarHBondContact O-CG1 3.43Å; V151-I155 PolarHBondContact O-N 3.34Å; V151-I155 VanDerWaalsContact O-N 3.16Å; V152-I155 PolarHBondContact O-N 3.49Å; G153-I155 PolarHBondContact O-N 3.03Å; I155-I157 VanDerWaalsContact C-N 3.34Å; I155-I157 PolarHBondContact O-N 2.97Å; I155-I158 PolarHBondContact O-N 2.9Å; I155-Q159 HydrophobicContact CG2-CG 4.39Å; I155-Q159 WeakPolarHBondContact O-CB 3.44Å; I155-Q159 WeakPolarHBondContact O-CG 3.33Å; I155-Q159 PolarHBondContact O-N 3.09Å
156	F	91.4	Very high	83.7	Confident	143 Å²	143	90.6 Å²	90.6	63%	0.627	55%	0.546	S	S	*	.	H	α-helix	trans	-60.4	-41.8	177.8	-88.1	-73.7	0	0	0	112.3	V152 G153 Q159 G160	V152-F156 HydrophobicContact CG1-CD2 3.64Å; V152-F156 HydrophobicContact CG1-CE2 3.55Å; V152-F156 VanDerWaalsContact O-CD2 3.3Å; V152-F156 WeakPolarHBondContact O-CD2 3.43Å; V152-F156 PolarHBondContact O-N 2.9Å; G153-F156 PolarHBondContact O-N 3.48Å; F156-Q159 PolarHBondContact O-N 3.48Å; F156-G160 PolarHBondContact O-N 3.02Å
157	I	91.4	Very high	81.6	Confident	110 Å²	110	93.5 Å²	93.5	56%	0.564	56%	0.56	S	S	*	*	H	α-helix	trans	-63.4	-47.2	176.7	-68.6	169.8	0	0	0	110.8	G153 T154 I155 Q159 G160 L161	G153-I157 WeakPolarHBondContact O-CG1 3.19Å; G153-I157 PolarHBondContact O-N 2.8Å; T154-I157 PolarHBondContact O-N 3.03Å; I155-I157 VanDerWaalsContact C-N 3.34Å; I155-I157 PolarHBondContact O-N 2.97Å; I157-Q159 VanDerWaalsContact C-N 3.33Å; I157-Q159 PolarHBondContact O-N 3.47Å; I157-G160 PolarHBondContact O-N 3.14Å; I157-L161 HydrophobicContact CG2-CD1 3.84Å; I157-L161 HydrophobicContact CG2-CG 4.36Å; I157-L161 VanDerWaalsContact O-CG 3.31Å; I157-L161 WeakPolarHBondContact O-CG 3.37Å; I157-L161 PolarHBondContact O-N 3.12Å
158	I	89.6	Confident	79.5	Confident	82 Å²	82	98.3 Å²	98.3	42%	0.421	57%	0.57	S	S	.	*	H	α-helix	trans	-62.7	-41.4	179.4	-68	165.4	0	0	0	110.9	T154 I155 L161 R162	T154-I158 VanDerWaalsContact O-CG1 3.27Å; T154-I158 WeakPolarHBondContact O-CG1 3.5Å; T154-I158 PolarHBondContact O-N 3.48Å; I155-I158 PolarHBondContact O-N 2.9Å; I158-L161 PolarHBondContact O-N 3.01Å; I158-R162 HydrophobicContact CG2-CG 4.37Å; I158-R162 WeakPolarHBondContact O-CB 3.29Å; I158-R162 VanDerWaalsContact O-CG 3.28Å; I158-R162 WeakPolarHBondContact O-CG 3.49Å; I158-R162 PolarHBondContact O-N 3.4Å
159	Q	79.8	Confident	77.4	Confident	108 Å²	108	101.3 Å²	101.3	51%	0.505	58%	0.578	S	S	.	*	H	α-helix	trans	-63.7	-44.5	175.7	-73.5	178.7	8.8	0	0	111.3	I155 F156 I157 L161 R162 S163	I155-Q159 HydrophobicContact CG2-CG 4.39Å; I155-Q159 WeakPolarHBondContact O-CB 3.44Å; I155-Q159 WeakPolarHBondContact O-CG 3.33Å; I155-Q159 PolarHBondContact O-N 3.09Å; F156-Q159 PolarHBondContact O-N 3.48Å; I157-Q159 VanDerWaalsContact C-N 3.33Å; I157-Q159 PolarHBondContact O-N 3.47Å; Q159-L161 VanDerWaalsContact C-N 3.34Å; Q159-L161 PolarHBondContact O-N 3Å; Q159-R162 PolarHBondContact O-N 3.03Å; Q159-S163 WeakPolarHBondContact O-CB 3.24Å; Q159-S163 PolarHBondContact O-N 3Å; Q159-S163 PolarHBondContact O-OG 3.21Å; Q159-S163 VanDerWaalsContact O-OG 3.08Å
160	G	77.9	Confident	75.8	Confident	48 Å²	48	104.9 Å²	104.9	50%	0.495	59%	0.593	S	S	.	*	H	α-helix	trans	-59.8	-41.3	175.1	0	0	0	0	0	113.3	F156 I157 G164	F156-G160 PolarHBondContact O-N 3.02Å; I157-G160 PolarHBondContact O-N 3.14Å; G160-G164 PolarHBondContact O-N 2.88Å
161	L	73.8	Confident	73.5	Confident	129 Å²	129	102.8 Å²	102.8	68%	0.675	60%	0.599	S	S	*	*	H	α-helix	trans	-70.5	-35.4	177.2	-68.4	172.1	0	0	0	112.7	I157 I158 Q159	I157-L161 HydrophobicContact CG2-CD1 3.84Å; I157-L161 HydrophobicContact CG2-CG 4.36Å; I157-L161 VanDerWaalsContact O-CG 3.31Å; I157-L161 WeakPolarHBondContact O-CG 3.37Å; I157-L161 PolarHBondContact O-N 3.12Å; I158-L161 PolarHBondContact O-N 3.01Å; Q159-L161 VanDerWaalsContact C-N 3.34Å; Q159-L161 PolarHBondContact O-N 3Å
162	R	68.7	Low	72	Confident	195 Å²	195	105.6 Å²	105.6	74%	0.736	62%	0.619	S	S	*	*	H	α-helix	trans	-71.6	-37.7	174.6	-73.7	176.7	177.5	-174.8	0.3	112.1	I158 Q159 G164 G165	I158-R162 HydrophobicContact CG2-CG 4.37Å; I158-R162 WeakPolarHBondContact O-CB 3.29Å; I158-R162 VanDerWaalsContact O-CG 3.28Å; I158-R162 WeakPolarHBondContact O-CG 3.49Å; I158-R162 PolarHBondContact O-N 3.4Å; Q159-R162 PolarHBondContact O-N 3.03Å; R162-G164 VanDerWaalsContact C-N 3.35Å; R162-G165 PolarHBondContact O-N 3.37Å
163	S	60	Low	69.6	Low	108 Å²	108	114.3 Å²	114.3	76%	0.755	66%	0.662	S	S	*	*	H	α-helix	trans	-74.2	-22.6	177.3	-64.5	0	0	0	0	113.4	Q159	Q159-S163 WeakPolarHBondContact O-CB 3.24Å; Q159-S163 PolarHBondContact O-N 3Å; Q159-S163 PolarHBondContact O-OG 3.21Å; Q159-S163 VanDerWaalsContact O-OG 3.08Å
164	G	60	Low	68.4	Low	71 Å²	71	118.5 Å²	118.5	73%	0.732	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-2.4	172.6	0	0	0	0	0	115.2	G160 R162	G160-G164 PolarHBondContact O-N 2.88Å; R162-G164 VanDerWaalsContact C-N 3.35Å
165	G	59.2	Low	67.1	Low	55 Å²	55	121.2 Å²	121.2	57%	0.567	69%	0.693	S	S	*	*	S	Bend	trans	-106.4	21.8	-167	0	0	0	0	0	116.8	R162	R162-G165 PolarHBondContact O-N 3.37Å
166	T	55.4	Low	65.7	Low	131 Å²	131	123.4 Å²	123.4	80%	0.804	71%	0.708	S	S	*	*			trans	-151.1	125.5	172.9	-32.6	0	0	0	0	114
167	S	51.2	Low	64.2	Low	97 Å²	97	122.2 Å²	122.2	68%	0.678	71%	0.713	S	S	*	*			trans	93.2	116.5	175.2	-169.8	0	0	0	0	114.6
168	R	51.3	Low	62.5	Low	218 Å²	218	123 Å²	123	82%	0.823	72%	0.723	S	S	*	*			cis	-169.4	162.4	11.7	-101.4	168.8	-168.2	162.3	2.4	105
169	H	53	Low	60.6	Low	157 Å²	157	125.7 Å²	125.7	73%	0.727	74%	0.743	S	S	*	*			cis	-172.7	150.5	25.8	-131.3	-19.8	0	0	0	109
170	P	61.4	Low	59.3	Low	119 Å²	119	127 Å²	127	77%	0.773	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-81.5	125.7	153.7	-0.2	18.9	0	0	0	109.4
171	G	48.5	Very low	57.8	Low	69 Å²	69	133.1 Å²	133.1	71%	0.711	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-83.1	145.8	170.2	0	0	0	0	0	111.5
172	P	64.8	Low	56.5	Low	131 Å²	131	133.4 Å²	133.4	85%	0.851	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-85.1	166.6	-175.6	35.2	-32.4	0	0	0	113.1
173	L	44.8	Very low	55.4	Low	250 Å²	250	127.8 Å²	127.8	100%	1.309	79%	0.794	S	S	*	*			trans	-23.3	0	176.1	-64	169	0	0	0	117.1

Retrieved 173 of 173 residues in 144 ms (Link to these results)

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