LV310_HUMAN Loading...

Immunoglobulin lambda variable 3-10

V region of the variable domain of immunoglobulin light chains that participates in the antigen recognition¹. Immunoglobulins, also known as antibodies, are membrane-bound or secreted glycoproteins produced by B lymphocytes. In the recognition phase of humoral immunity, the membrane-bound immunoglobulins serve as receptors which, upon binding of a specific antigen, trigger the clonal expansion and differentiation of B lymphocytes into immunoglobulins-secreting plasma cells. Secreted immunoglobulins mediate the effector phase of humoral immunity, which results in the elimination of bound antigens^2,3. The antigen binding site is formed by the variable domain of one heavy chain, together with that of its associated light chain. Thus, each immunoglobulin has two antigen binding sites with remarkable affinity for a particular antigen. The variable domains are assembled by a process called V-(D)-J rearrangement and can then be subjected to somatic hypermutations which, after exposure to antigen and selection, allow affinity maturation for a particular antigen^4,5.

AlphaFold DB , UniProt , Accession A0A075B6K4, Species HUMAN (Homo sapiens, Human), Gene IGLV3-10, Length 115 aa.

						>LV310_HUMAN|A0A075B6K4|IGLV3-10
MAWTPLLLPLLTFCTVSEASYELTQPPSVSVSPGQTARITCSGDALPKKYAYWYQQKSGQAPVLVIYEDSKRPSGIPERFSGSSSGTMATLTISGAQVEDEADYYCYSTDSSGNH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	52.2	Low	63.7	Low	243 Å²	243	157 Å²	157	100%	1.197	84%	0.844	S	S	*	*				0	130.1	0	-69.8	-176.8	-162.2	0	0	107.6
2	A	58.3	Low	64.3	Low	98 Å²	98	153.7 Å²	153.7	81%	0.81	83%	0.833	S	S	*	*			trans	51.3	87.2	-177.7	0	0	0	0	0	117.1
3	W	55.9	Low	64.5	Low	255 Å²	255	155.5 Å²	155.5	97%	0.966	83%	0.829	S	S	*	*			trans	-99.6	120.6	158.7	-77.7	-17.2	0	0	0	109	P5	W3-P5 WeakPolarHBondContact O-CD 3.27Å
4	T	72.1	Confident	64.4	Low	132 Å²	132	152.8 Å²	152.8	81%	0.81	83%	0.827	S	S	*	*			trans	-88.4	109.9	175.6	-26.8	0	0	0	0	108.5	L6	T4-L6 PolarHBondContact O-N 3.44Å
5	P	61.3	Low	64.6	Low	109 Å²	109	151.3 Å²	151.3	71%	0.708	83%	0.825	S	S	*	*			trans	-63.9	115.4	170.2	17.1	-28.2	0	0	0	111.3	W3 L7	W3-P5 WeakPolarHBondContact O-CD 3.27Å; P5-L7 PolarHBondContact O-N 2.91Å
6	L	64	Low	64.5	Low	167 Å²	167	149.4 Å²	149.4	87%	0.874	82%	0.819	S	S	*	*			trans	-67.8	104	166.9	-94.9	145.7	0	0	0	108.9	T4	T4-L6 PolarHBondContact O-N 3.44Å
7	L	64.6	Low	64.2	Low	163 Å²	163	147.1 Å²	147.1	85%	0.853	82%	0.816	S	S	*	*			trans	-86	106.3	166.1	-73.1	164.5	0	0	0	108.1	P5	P5-L7 PolarHBondContact O-N 2.91Å
8	L	68.3	Low	63.5	Low	154 Å²	154	148.5 Å²	148.5	81%	0.806	82%	0.816	S	S	*	*			trans	-72.5	133.9	169.1	-85.9	146.6	0	0	0	109.2	L10	L8-L10 PolarHBondContact O-N 2.86Å
9	P	69.4	Low	63	Low	105 Å²	105	144.6 Å²	144.6	68%	0.682	81%	0.805	S	S	*	*			trans	-69.7	122.6	175.1	29.8	-30.2	0	0	0	108.2	L11	P9-L11 PolarHBondContact O-N 3.28Å; P9-L11 VanDerWaalsContact O-N 3.07Å
10	L	68.6	Low	62.6	Low	160 Å²	160	141.6 Å²	141.6	84%	0.838	79%	0.794	S	S	*	*			trans	-72.1	99.9	171.6	-157.1	78.4	0	0	0	107.4	L8 T12	L8-L10 PolarHBondContact O-N 2.86Å; L10-T12 PolarHBondContact O-N 3.43Å
11	L	66.6	Low	63	Low	141 Å²	141	139 Å²	139	74%	0.738	77%	0.773	S	S	*	*			trans	-72.9	92.8	172	-84.9	158.7	0	0	0	108.6	P9 F13	P9-L11 PolarHBondContact O-N 3.28Å; P9-L11 VanDerWaalsContact O-N 3.07Å; L11-F13 HydrophobicContact CB-CE2 4.38Å; L11-F13 PolarHBondContact O-N 3.05Å
12	T	70.3	Confident	64.6	Low	117 Å²	117	133.8 Å²	133.8	72%	0.718	75%	0.745	S	S	*	*			trans	-74.4	102.7	171.4	-32.4	0	0	0	0	108.5	L10 C14	L10-T12 PolarHBondContact O-N 3.43Å; T12-C14 PolarHBondContact O-N 3.4Å; T12-C14 VanDerWaalsContact O-N 3.11Å
13	F	67.1	Low	66.2	Low	177 Å²	177	131.3 Å²	131.3	78%	0.776	72%	0.718	S	S	*	*			trans	-70.8	101.2	169.8	-76.4	-91.1	0	0	0	108.8	L11 T15	L11-F13 HydrophobicContact CB-CE2 4.38Å; L11-F13 PolarHBondContact O-N 3.05Å; F13-T15 PolarHBondContact O-N 2.82Å; F13-T15 VanDerWaalsContact O-N 3.14Å
14	C	63.5	Low	68.2	Low	118 Å²	118	123 Å²	123	80%	0.797	70%	0.696	S	S	*	*			trans	-72.8	97.2	161.6	-91	0	0	0	0	108	T12 V16	T12-C14 PolarHBondContact O-N 3.4Å; T12-C14 VanDerWaalsContact O-N 3.11Å; C14-V16 PolarHBondContact O-N 3.3Å; C14-V16 VanDerWaalsContact O-N 3.1Å
15	T	67.6	Low	69.4	Low	130 Å²	130	119.4 Å²	119.4	80%	0.798	67%	0.67	S	S	*	*			trans	-71.8	98.7	162.8	51.4	0	0	0	0	107.5	F13 S17	F13-T15 PolarHBondContact O-N 2.82Å; F13-T15 VanDerWaalsContact O-N 3.14Å; T15-S17 PolarHBondContact O-N 2.88Å; T15-S17 VanDerWaalsContact O-N 3.15Å
16	V	62.2	Low	71.1	Confident	122 Å²	122	116.4 Å²	116.4	74%	0.739	65%	0.65	S	S	*	*			trans	-66.3	110.3	163	172.9	0	0	0	0	106.2	C14 E18	C14-V16 PolarHBondContact O-N 3.3Å; C14-V16 VanDerWaalsContact O-N 3.1Å; V16-E18 PolarHBondContact O-N 3.21Å
17	S	58.8	Low	72.7	Confident	109 Å²	109	115 Å²	115	76%	0.762	65%	0.651	S	S	*	*			trans	-77.2	100.4	170.3	176.3	0	0	0	0	107.5	T15 A19	T15-S17 PolarHBondContact O-N 2.88Å; T15-S17 VanDerWaalsContact O-N 3.15Å; S17-A19 PolarHBondContact O-N 3.31Å
18	E	52.2	Low	74.2	Confident	173 Å²	173	111.6 Å²	111.6	81%	0.808	64%	0.641	S	S	*	*			trans	-68.2	118.5	160.8	-65.7	-139.8	152.9	0	0	107.8	V16 S20	V16-E18 PolarHBondContact O-N 3.21Å; E18-S20 PolarHBondContact O-N 3.04Å
19	A	54.9	Low	75.6	Confident	74 Å²	74	107.2 Å²	107.2	61%	0.612	62%	0.62	S	S	*	*			trans	-67	104	173.8	0	0	0	0	0	108.3	S17 Y21	S17-A19 PolarHBondContact O-N 3.31Å; A19-Y21 PolarHBondContact O-N 3.33Å
20	S	55.1	Low	77	Confident	84 Å²	84	107.6 Å²	107.6	59%	0.587	63%	0.626	S	S	*	*			trans	-72.3	125	168.7	66.2	0	0	0	0	108.4	E18 E22	E18-S20 PolarHBondContact O-N 3.04Å; S20-E22 PolarHBondContact O-N 2.94Å
21	Y	70	Confident	78.3	Confident	88 Å²	88	103 Å²	103	35%	0.345	60%	0.604	S	S	.	*			trans	-81.3	64	168.5	-68.4	-77.3	0	0	0	108.6	A19 A45 S111	A19-Y21 PolarHBondContact O-N 3.33Å; Y21-A45 HydrophobicContact CD1-CB 3.72Å; Y21-A45 HydrophobicContact CG-CB 4.35Å; Y21-S111 WeakPolarHBondContact CE2-OG 3.24Å; Y21-S111 PolarHBondContact OH-OG 3.01Å
22	E	86.3	Confident	79.8	Confident	134 Å²	134	100.1 Å²	100.1	63%	0.626	60%	0.596	S	S	*	*			trans	-83.3	139.5	179.2	-165.1	175.4	164.8	0	0	110.3	S20	S20-E22 PolarHBondContact O-N 2.94Å
23	L	92.7	Very high	81.1	Confident	45 Å²	45	99.4 Å²	99.4	24%	0.236	59%	0.593	C	S	.	*			trans	-103.6	129.5	172	-63.9	177.4	0	0	0	108.8	S42 L46	L23-S42 CarbonylContact C-O 3.57Å; L23-S42 WeakPolarHBondContact CA-O 3.39Å; L23-L46 HydrophobicContact CD2-CD1 4.3Å; L23-L46 HydrophobicContact CD2-CD2 4.15Å; L23-L46 HydrophobicContact CD2-CG 4.03Å
24	T	95.8	Very high	82.6	Confident	81 Å²	81	93.4 Å²	93.4	50%	0.497	58%	0.581	S	S	.	*	B	Isolated β-bridge	trans	-110.9	134.9	178.9	-49.4	0	0	0	0	110.5	C41 S42	T24-C41 CarbonylContact O-C 3.58Å; T24-C41 WeakPolarHBondContact O-CA 3.33Å; T24-S42 PolarHBondContact N-O 2.81Å; T24-S42 PolarHBondContact O-N 3.45Å
25	Q	97.4	Very high	84.2	Confident	57 Å²	57	93.4 Å²	93.4	27%	0.266	57%	0.569	S	S	.	*			trans	-127.5	156.3	176.4	-76.5	177.3	-137	0	0	110.7	C41 Y104 C106	Q25-C41 HydrophobicContact CG-CB 4.12Å; Q25-Y104 PolarHBondContact NE2-O 2.87Å; Q25-C106 HydrophobicContact CG-CB 4.34Å
26	P	97.6	Very high	85.7	Confident	46 Å²	46	90.7 Å²	90.7	30%	0.299	55%	0.553	S	S	.	*			trans	-62.7	145.6	166.4	29	-33.7	0	0	0	109.8	S28 V29 T40	P26-S28 VanDerWaalsContact C-N 3.25Å; P26-S28 PolarHBondContact O-N 2.87Å; P26-V29 HydrophobicContact CG-CG2 3.93Å; P26-T40 WeakPolarHBondContact CD-O 3.26Å
27	P	97.1	Very high	87.4	Confident	138 Å²	138	85.4 Å²	85.4	90%	0.896	52%	0.521	S	S	*	.	S	Bend	trans	-67.6	-26.4	-178	27.5	-35.4	0	0	0	113
28	S	97.3	Very high	89.3	Confident	90 Å²	90	87 Å²	87	63%	0.629	51%	0.511	S	S	*	.			trans	-157.7	155.5	174.6	62.6	0	0	0	0	111.3	P26	P26-S28 VanDerWaalsContact C-N 3.25Å; P26-S28 PolarHBondContact O-N 2.87Å
29	V	97.6	Very high	91.5	Very high	62 Å²	62	79.5 Å²	79.5	38%	0.376	48%	0.476	S	S	.	.			trans	-134.9	131.8	169.4	177.8	0	0	0	0	106.9	P26 I39	P26-V29 HydrophobicContact CG-CG2 3.93Å; V29-I39 HydrophobicContact CB-CG1 4.46Å; V29-I39 HydrophobicContact CG2-CG1 4.26Å
30	S	97.4	Very high	93.6	Very high	114 Å²	114	79.1 Å²	79.1	80%	0.797	47%	0.466	S	S	*	.			trans	-130.8	134.6	179.1	-56.9	0	0	0	0	110.2
31	V	97.8	Very high	95.6	Very high	63 Å²	63	75.1 Å²	75.1	38%	0.382	44%	0.438	S	S	.	.			trans	-140.7	155.1	177.7	-61.1	0	0	0	0	109.7	Q35 A37 A96	V31-Q35 HydrophobicContact CB-CB 4.08Å; V31-A37 HydrophobicContact CG1-CB 4.17Å; V31-A37 HydrophobicContact CG2-CB 3.88Å; V31-A96 HydrophobicContact CG2-CB 3.68Å
32	S	97.6	Very high	96.8	Very high	81 Å²	81	73.2 Å²	73.2	57%	0.566	44%	0.438	S	S	*	.			trans	-72.6	152.1	171.1	-55.5	0	0	0	0	111.2	G34 Q35	S32-G34 PolarHBondContact O-N 2.97Å; S32-Q35 VanDerWaalsContact O-CB 3.27Å; S32-Q35 WeakPolarHBondContact O-CB 3.42Å; S32-Q35 PolarHBondContact O-N 3.2Å
33	P	97.3	Very high	97.2	Very high	102 Å²	102	67.3 Å²	67.3	66%	0.662	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	136.6	173.6	-27.8	35.5	0	0	0	112.4	Q35 A96	P33-Q35 VanDerWaalsContact C-N 3.29Å; P33-Q35 PolarHBondContact O-N 2.9Å; P33-A96 CarbonylContact C-O 3.59Å; P33-A96 WeakPolarHBondContact CA-O 3.34Å
34	G	98.1	Very high	97	Very high	50 Å²	50	70.6 Å²	70.6	52%	0.515	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-11.2	-176.6	0	0	0	0	0	115.2	S32 A96	S32-G34 PolarHBondContact O-N 2.97Å; G34-A96 PolarHBondContact N-O 2.69Å
35	Q	98.5	Very high	96.7	Very high	119 Å²	119	67 Å²	67	56%	0.556	41%	0.409	S	S	*	.	S	Bend	trans	-79.9	169.3	172.8	-65.2	-66.7	-69.8	0	0	111.7	V31 S32 P33 G95 A96	V31-Q35 HydrophobicContact CB-CB 4.08Å; S32-Q35 VanDerWaalsContact O-CB 3.27Å; S32-Q35 WeakPolarHBondContact O-CB 3.42Å; S32-Q35 PolarHBondContact O-N 3.2Å; P33-Q35 VanDerWaalsContact C-N 3.29Å; P33-Q35 PolarHBondContact O-N 2.9Å; Q35-G95 PolarHBondContact O-N 3.21Å; Q35-A96 WeakPolarHBondContact O-CB 3.21Å; Q35-A96 PolarHBondContact O-N 2.87Å
36	T	98.5	Very high	96.4	Very high	73 Å²	73	64.6 Å²	64.6	45%	0.448	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-94	119.5	175.9	-61.4	0	0	0	0	110.2	R38 T92 I93	T36-R38 HydrophobicContact CG2-CG 4.31Å; T36-T92 HydrophobicContact CG2-CG2 3.54Å; T36-I93 CarbonylContact C-O 3.59Å; T36-I93 WeakPolarHBondContact CA-O 3.14Å
37	A	98.4	Very high	96	Very high	10 Å²	10	66.2 Å²	66.2	8%	0.083	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	138.9	168.8	0	0	0	0	0	110.4	V31 T92 I93	V31-A37 HydrophobicContact CG1-CB 4.17Å; V31-A37 HydrophobicContact CG2-CB 3.88Å; A37-T92 WeakPolarHBondContact O-CA 3.46Å; A37-I93 HydrophobicContact CB-CB 4.27Å; A37-I93 PolarHBondContact N-O 2.88Å; A37-I93 PolarHBondContact O-N 2.66Å
38	R	98.3	Very high	95.7	Very high	144 Å²	144	66.8 Å²	66.8	54%	0.543	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	117.5	173.1	-63.2	179.2	72	88.6	-0.4	108.8	T36 T90 L91 T92	T36-R38 HydrophobicContact CG2-CG 4.31Å; R38-T90 HydrophobicContact CB-CG2 4.25Å; R38-L91 CarbonylContact C-O 3.5Å; R38-L91 WeakPolarHBondContact CA-O 3.38Å; R38-T92 HydrophobicContact CG-CG2 4.43Å
39	I	98.4	Very high	95.4	Very high	14 Å²	14	65.3 Å²	65.3	7%	0.072	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.9	177.4	-49.9	178.4	0	0	0	107.1	V29 W53 T90 L91 Y104	V29-I39 HydrophobicContact CB-CG1 4.46Å; V29-I39 HydrophobicContact CG2-CG1 4.26Å; I39-W53 HydrophobicContact CB-CH2 4.17Å; I39-W53 HydrophobicContact CB-CZ3 4.08Å; I39-W53 HydrophobicContact CG2-CH2 3.93Å; I39-W53 HydrophobicContact CG2-CZ3 3.71Å; I39-W53 VanDerWaalsContact O-CH2 3.28Å; I39-W53 WeakPolarHBondContact O-CH2 3.36Å; I39-T90 CarbonylContact O-C 3.55Å; I39-T90 VanDerWaalsContact O-CA 3.3Å; I39-T90 WeakPolarHBondContact O-CA 3.41Å; I39-L91 HydrophobicContact CB-CB 4.41Å; I39-L91 HydrophobicContact CD1-CD2 4.43Å; I39-L91 PolarHBondContact N-O 2.86Å; I39-L91 PolarHBondContact O-N 3.16Å; I39-Y104 HydrophobicContact CD1-CD1 4.26Å; I39-Y104 HydrophobicContact CD1-CD2 3.51Å; I39-Y104 HydrophobicContact CD1-CE2 4.17Å; I39-Y104 HydrophobicContact CD1-CG 3.55Å
40	T	98.2	Very high	95.2	Very high	66 Å²	66	68 Å²	68	41%	0.405	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	147.3	-178.5	54.9	0	0	0	0	111	P26 A89 T90	P26-T40 WeakPolarHBondContact CD-O 3.26Å; T40-A89 CarbonylContact C-O 3.55Å; T40-A89 WeakPolarHBondContact CA-O 3.4Å; T40-T90 HydrophobicContact CG2-CG2 4.42Å
41	C	97.2	Very high	95.1	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.007	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.4	175.9	169.8	0	0	0	0	107.8	T24 Q25 W53 M88 A89 C106	T24-C41 CarbonylContact O-C 3.58Å; T24-C41 WeakPolarHBondContact O-CA 3.33Å; Q25-C41 HydrophobicContact CG-CB 4.12Å; C41-W53 HydrophobicContact CB-CH2 3.7Å; C41-W53 HydrophobicContact CB-CZ2 3.79Å; C41-M88 CarbonylContact O-C 3.58Å; C41-M88 VanDerWaalsContact O-CA 3.31Å; C41-M88 WeakPolarHBondContact O-CA 3.14Å; C41-A89 HydrophobicContact CB-CB 4.31Å; C41-A89 PolarHBondContact N-O 3.33Å; C41-A89 PolarHBondContact O-N 2.84Å; C41-C106 HydrophobicContact CB-CB 3.39Å; C41-C106 WeakPolarHBondContact CB-SG 3.36Å; C41-C106 WeakPolarHBondContact SG-CB 3.29Å; C41-C106 CovalentContact SG-SG 2.04Å; C41-C106 PolarHBondContact SG-SG 2.77Å
42	S	96.2	Very high	95.1	Very high	48 Å²	48	62.2 Å²	62.2	34%	0.336	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.1	178.1	58.8	0	0	0	0	111.6	L23 T24 T87	L23-S42 CarbonylContact C-O 3.57Å; L23-S42 WeakPolarHBondContact CA-O 3.39Å; T24-S42 PolarHBondContact N-O 2.81Å; T24-S42 PolarHBondContact O-N 3.45Å; S42-T87 CarbonylContact C-O 3.6Å; S42-T87 WeakPolarHBondContact CA-O 3.42Å
43	G	92.9	Very high	95.2	Very high	10 Å²	10	58.4 Å²	58.4	10%	0.103	31%	0.311	C	S	.	.			trans	177.2	156.2	171.3	0	0	0	0	0	113.5	A45 L46 T87	G43-A45 PolarHBondContact O-N 2.79Å; G43-L46 WeakPolarHBondContact O-CB 3.3Å; G43-L46 PolarHBondContact O-N 3.44Å; G43-T87 PolarHBondContact N-O 2.82Å
44	D	90.3	Very high	95.2	Very high	113 Å²	113	57.1 Å²	57.1	60%	0.604	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.3	-171.9	-68.3	-26.5	0	0	0	113.9	P47	D44-P47 WeakPolarHBondContact O-CD 3.28Å
45	A	87.8	Confident	95.2	Very high	5 Å²	5	56 Å²	56	4%	0.041	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-31.1	174.6	0	0	0	0	0	112.7	Y21 G43 K48 K49	Y21-A45 HydrophobicContact CD1-CB 3.72Å; Y21-A45 HydrophobicContact CG-CB 4.35Å; G43-A45 PolarHBondContact O-N 2.79Å; A45-K48 PolarHBondContact O-N 2.93Å; A45-K49 PolarHBondContact O-N 2.9Å; A45-K49 VanDerWaalsContact O-N 3.15Å
46	L	91	Very high	95.2	Very high	7 Å²	7	52.9 Å²	52.9	4%	0.037	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-33.3	-170.7	-64.8	177	0	0	0	115.1	L23 G43 K48 A51 T87 A89	L23-L46 HydrophobicContact CD2-CD1 4.3Å; L23-L46 HydrophobicContact CD2-CD2 4.15Å; L23-L46 HydrophobicContact CD2-CG 4.03Å; G43-L46 WeakPolarHBondContact O-CB 3.3Å; G43-L46 PolarHBondContact O-N 3.44Å; L46-K48 PolarHBondContact O-N 3.2Å; L46-A51 HydrophobicContact CD2-CB 3.96Å; L46-T87 WeakPolarHBondContact CD1-O 3.35Å; L46-A89 HydrophobicContact CD1-CB 4Å; L46-A89 HydrophobicContact CD2-CB 4.39Å
47	P	90.7	Very high	95.1	Very high	80 Å²	80	52.4 Å²	52.4	52%	0.519	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.9	174.7	-18.3	29.2	0	0	0	113.8	D44 G86 T87	D44-P47 WeakPolarHBondContact O-CD 3.28Å; P47-G86 WeakPolarHBondContact CG-O 3.24Å; P47-T87 HydrophobicContact CG-CG2 3.66Å
48	K	89.6	Confident	95	Very high	150 Å²	150	58 Å²	58	65%	0.652	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-13	-172.3	-62.9	177.8	-176.7	170	0	112.7	A45 L46	A45-K48 PolarHBondContact O-N 2.93Å; L46-K48 PolarHBondContact O-N 3.2Å
49	K	91.2	Very high	94.9	Very high	60 Å²	60	55.2 Å²	55.2	26%	0.261	31%	0.307	S	S	.	.	S	Bend	trans	-144.7	160.4	-167.7	-61.3	-63.8	-162.9	157.8	0	109.9	A45 S108 T109 D110	A45-K49 PolarHBondContact O-N 2.9Å; A45-K49 VanDerWaalsContact O-N 3.15Å; K49-S108 WeakPolarHBondContact CB-OG 3.29Å; K49-T109 HydrophobicContact CB-CG2 3.94Å; K49-T109 HydrophobicContact CD-CG2 3.41Å; K49-T109 VanDerWaalsContact CD-CG2 3.41Å; K49-T109 HydrophobicContact CG-CG2 3.75Å; K49-T109 WeakPolarHBondContact CG-O 3.38Å; K49-D110 VanDerWaalsContact CE-O 3.24Å; K49-D110 WeakPolarHBondContact CE-O 3.42Å; K49-D110 PolarHBondContact NZ-O 3.34Å
50	Y	94	Very high	94.8	Very high	119 Å²	119	59.9 Å²	59.9	47%	0.467	33%	0.328	S	S	.	.			trans	-76.5	142.5	178	-66.8	-54.6	0	0	0	112.6	Y52 E68 D69	Y50-Y52 WeakPolarHBondContact O-CD2 3.32Å; Y50-Y52 WeakPolarHBondContact O-CE2 3.07Å; Y50-E68 HydrophobicContact CD1-CB 4.13Å; Y50-E68 HydrophobicContact CD1-CG 4.38Å; Y50-E68 HydrophobicContact CD2-CB 4.37Å; Y50-E68 HydrophobicContact CD2-CG 3.73Å; Y50-E68 HydrophobicContact CE1-CB 4.4Å; Y50-E68 HydrophobicContact CE2-CG 3.99Å; Y50-E68 HydrophobicContact CG-CB 4.12Å; Y50-E68 HydrophobicContact CG-CG 3.94Å; Y50-D69 WeakPolarHBondContact CD1-OD2 3.19Å
51	A	95.7	Very high	94.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.339	C	S	.	.			trans	-81.8	139.9	164	0	0	0	0	0	111	L46 E68 D69 A89	L46-A51 HydrophobicContact CD2-CB 3.96Å; A51-E68 PolarHBondContact O-N 2.75Å; A51-D69 VanDerWaalsContact CB-OD1 3.32Å; A51-D69 WeakPolarHBondContact CB-OD1 3.49Å; A51-D69 PolarHBondContact N-OD1 3.15Å; A51-D69 PolarHBondContact O-N 2.83Å; A51-A89 HydrophobicContact CB-CB 3.62Å
52	Y	97.6	Very high	94.8	Very high	55 Å²	55	63.6 Å²	63.6	22%	0.216	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.4	171.8	-59.5	-101.5	0	0	0	108.2	Y50 L64 I66 C106 Y107	Y50-Y52 WeakPolarHBondContact O-CD2 3.32Å; Y50-Y52 WeakPolarHBondContact O-CE2 3.07Å; Y52-L64 HydrophobicContact CD1-CD1 4.15Å; Y52-I66 CarbonylContact C-O 3.57Å; Y52-I66 WeakPolarHBondContact CA-O 3.48Å; Y52-C106 CarbonylContact O-C 3.52Å; Y52-C106 WeakPolarHBondContact O-CA 3.38Å; Y52-Y107 AromaticContact CD2-CD1 3.96Å; Y52-Y107 HydrophobicContact CD2-CD1 3.96Å; Y52-Y107 HydrophobicContact CG-CD1 4.28Å; Y52-Y107 PolarHBondContact N-O 2.64Å; Y52-Y107 PolarHBondContact O-N 3.2Å
53	W	98.4	Very high	94.9	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.5	176.6	-68.6	88.2	0	0	0	110.2	I39 C41 V65 I66 A89 L91 Y105 C106	I39-W53 HydrophobicContact CB-CH2 4.17Å; I39-W53 HydrophobicContact CB-CZ3 4.08Å; I39-W53 HydrophobicContact CG2-CH2 3.93Å; I39-W53 HydrophobicContact CG2-CZ3 3.71Å; I39-W53 VanDerWaalsContact O-CH2 3.28Å; I39-W53 WeakPolarHBondContact O-CH2 3.36Å; C41-W53 HydrophobicContact CB-CH2 3.7Å; C41-W53 HydrophobicContact CB-CZ2 3.79Å; W53-V65 HydrophobicContact CB-CG2 3.71Å; W53-V65 VanDerWaalsContact O-CG2 3.29Å; W53-V65 WeakPolarHBondContact O-CG2 3.5Å; W53-V65 PolarHBondContact O-N 3.46Å; W53-I66 HydrophobicContact CB-CB 4.07Å; W53-I66 HydrophobicContact CG-CB 4.38Å; W53-I66 PolarHBondContact N-O 3.46Å; W53-I66 PolarHBondContact O-N 3.46Å; W53-A89 HydrophobicContact CZ2-CB 4.29Å; W53-L91 HydrophobicContact CB-CD1 4.27Å; W53-L91 HydrophobicContact CB-CD2 4.31Å; W53-L91 HydrophobicContact CD2-CB 3.54Å; W53-L91 HydrophobicContact CD2-CD2 4.14Å; W53-L91 HydrophobicContact CD2-CG 4.28Å; W53-L91 HydrophobicContact CE3-CB 3.73Å; W53-L91 HydrophobicContact CE3-CD2 3.89Å; W53-L91 HydrophobicContact CE3-CG 4.4Å; W53-L91 HydrophobicContact CG-CB 4.03Å; W53-L91 HydrophobicContact CG-CD1 4.15Å; W53-L91 HydrophobicContact CG-CD2 4.34Å; W53-L91 HydrophobicContact CG-CG 4.42Å; W53-L91 HydrophobicContact CH2-CB 4.05Å; W53-L91 HydrophobicContact CZ2-CB 3.88Å; W53-L91 HydrophobicContact CZ3-CB 3.98Å; W53-Y105 CarbonylContact C-O 3.52Å; W53-Y105 WeakPolarHBondContact CA-O 3.29Å; W53-C106 HydrophobicContact CD2-CB 4.44Å; W53-C106 HydrophobicContact CE3-CB 4.2Å; W53-C106 HydrophobicContact CH2-CB 4.06Å; W53-C106 HydrophobicContact CZ2-CB 4.29Å; W53-C106 HydrophobicContact CZ3-CB 4Å
54	Y	98.3	Very high	95.1	Very high	76 Å²	76	66.5 Å²	66.5	30%	0.298	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.2	175	-67.8	-96.9	0	0	0	110.1	P62 V63 L64 Y104 Y105	Y54-P62 HydrophobicContact CD1-CB 4.22Å; Y54-V63 CarbonylContact C-O 3.56Å; Y54-V63 VanDerWaalsContact CA-O 3.24Å; Y54-V63 WeakPolarHBondContact CA-O 3.36Å; Y54-L64 HydrophobicContact CD1-CB 4.17Å; Y54-L64 HydrophobicContact CD1-CD1 4.43Å; Y54-L64 HydrophobicContact CD2-CD1 4.39Å; Y54-L64 HydrophobicContact CE1-CB 3.86Å; Y54-L64 HydrophobicContact CE1-CD1 3.98Å; Y54-L64 HydrophobicContact CE2-CD1 3.93Å; Y54-Y104 CarbonylContact O-C 2.99Å; Y54-Y104 WeakPolarHBondContact O-CA 3.3Å; Y54-Y105 PolarHBondContact N-O 2.97Å; Y54-Y105 PolarHBondContact O-N 3.15Å
55	Q	98.4	Very high	95.5	Very high	25 Å²	25	61.2 Å²	61.2	12%	0.117	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.9	170.4	-177.5	-171.9	56.7	0	0	108.8	P62 V63 V65 A102 Y104	Q55-P62 CarbonylContact O-C 3.54Å; Q55-P62 WeakPolarHBondContact O-CA 3.45Å; Q55-V63 PolarHBondContact N-O 2.82Å; Q55-V63 PolarHBondContact O-N 2.64Å; Q55-V65 HydrophobicContact CB-CG1 3.64Å; Q55-A102 HydrophobicContact CG-CB 3.44Å; Q55-A102 VanDerWaalsContact CG-CB 3.44Å; Q55-Y104 HydrophobicContact CB-CD1 4.15Å; Q55-Y104 HydrophobicContact CB-CE1 3.85Å; Q55-Y104 HydrophobicContact CG-CD1 4.33Å; Q55-Y104 HydrophobicContact CG-CE1 3.73Å; Q55-Y104 PolarHBondContact NE2-OH 3.42Å
56	Q	98.2	Very high	96	Very high	55 Å²	55	61 Å²	61	26%	0.257	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	114.3	173.5	-171.2	179.2	12.8	0	0	110.2	Q60 P62 A102 D103 Y105	Q56-Q60 WeakPolarHBondContact CG-O 3.02Å; Q56-Q60 PolarHBondContact NE2-O 2.94Å; Q56-P62 HydrophobicContact CB-CB 4.43Å; Q56-P62 HydrophobicContact CB-CG 4.26Å; Q56-P62 HydrophobicContact CG-CG 4.15Å; Q56-A102 WeakPolarHBondContact O-CB 3.32Å; Q56-D103 HydrophobicContact CB-CB 4.42Å; Q56-D103 PolarHBondContact N-O 3.49Å; Q56-D103 PolarHBondContact O-N 2.81Å; Q56-Y105 HydrophobicContact CB-CD2 4.4Å; Q56-Y105 HydrophobicContact CB-CE2 3.82Å; Q56-Y105 VanDerWaalsContact OE1-CE2 3.3Å; Q56-Y105 PolarHBondContact OE1-OH 3.05Å
57	K	97.1	Very high	96.3	Very high	62 Å²	62	64.2 Å²	64.2	27%	0.27	35%	0.354	S	S	.	.			trans	-84.9	155.2	171.1	-64.7	-178.9	176.8	-170.2	0	110	G59 Q60 E99 A102	K57-G59 PolarHBondContact O-N 2.94Å; K57-Q60 HydrophobicContact CB-CB 4.25Å; K57-Q60 HydrophobicContact CB-CG 4.22Å; K57-Q60 PolarHBondContact O-N 2.83Å; K57-E99 WeakPolarHBondContact CE-O 3.32Å; K57-E99 PolarHBondContact NZ-O 2.8Å; K57-A102 HydrophobicContact CG-CB 4.09Å
58	S	95.7	Very high	96.6	Very high	127 Å²	127	63.1 Å²	63.1	89%	0.888	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	124.5	178.8	-174.2	0	0	0	0	111.4	Q60	S58-Q60 VanDerWaalsContact C-N 3.26Å; S58-Q60 PolarHBondContact O-N 3.38Å
59	G	95.8	Very high	96.9	Very high	87 Å²	87	57.7 Å²	57.7	90%	0.897	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	6.1	-178.9	0	0	0	0	0	115.8	K57	K57-G59 PolarHBondContact O-N 2.94Å
60	Q	96.7	Very high	97.3	Very high	111 Å²	111	58.6 Å²	58.6	52%	0.519	33%	0.334	S	S	.	.	S	Bend	trans	-110.3	157.4	178.7	-60.4	-173.7	-3.1	0	0	111.6	Q56 K57 S58	Q56-Q60 WeakPolarHBondContact CG-O 3.02Å; Q56-Q60 PolarHBondContact NE2-O 2.94Å; K57-Q60 HydrophobicContact CB-CB 4.25Å; K57-Q60 HydrophobicContact CB-CG 4.22Å; K57-Q60 PolarHBondContact O-N 2.83Å; S58-Q60 VanDerWaalsContact C-N 3.26Å; S58-Q60 PolarHBondContact O-N 3.38Å
61	A	97	Very high	97.5	Very high	76 Å²	76	57.6 Å²	57.6	63%	0.628	33%	0.332	S	S	*	.			trans	-71.4	149.7	170.5	0	0	0	0	0	110.4
62	P	97.6	Very high	97.6	Very high	69 Å²	69	60.8 Å²	60.8	45%	0.448	34%	0.344	S	S	.	.			trans	-58.7	136.8	172.9	-23.9	33.6	0	0	0	112.5	Y54 Q55 Q56	Y54-P62 HydrophobicContact CD1-CB 4.22Å; Q55-P62 CarbonylContact O-C 3.54Å; Q55-P62 WeakPolarHBondContact O-CA 3.45Å; Q56-P62 HydrophobicContact CB-CB 4.43Å; Q56-P62 HydrophobicContact CB-CG 4.26Å; Q56-P62 HydrophobicContact CG-CG 4.15Å
63	V	97.9	Very high	97.6	Very high	70 Å²	70	59.8 Å²	59.8	42%	0.424	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.1	177.6	178.6	0	0	0	0	109.5	Y54 Q55 V65 I76	Y54-V63 CarbonylContact C-O 3.56Å; Y54-V63 VanDerWaalsContact CA-O 3.24Å; Y54-V63 WeakPolarHBondContact CA-O 3.36Å; Q55-V63 PolarHBondContact N-O 2.82Å; Q55-V63 PolarHBondContact O-N 2.64Å; V63-V65 PolarHBondContact O-N 2.78Å; V63-I76 HydrophobicContact CG1-CD1 4.39Å
64	L	98.3	Very high	97.5	Very high	50 Å²	50	65.7 Å²	65.7	26%	0.262	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	122.2	176	-177	66.5	0	0	0	110.3	Y52 Y54 I66 P73	Y52-L64 HydrophobicContact CD1-CD1 4.15Å; Y54-L64 HydrophobicContact CD1-CB 4.17Å; Y54-L64 HydrophobicContact CD1-CD1 4.43Å; Y54-L64 HydrophobicContact CD2-CD1 4.39Å; Y54-L64 HydrophobicContact CE1-CB 3.86Å; Y54-L64 HydrophobicContact CE1-CD1 3.98Å; Y54-L64 HydrophobicContact CE2-CD1 3.93Å; L64-I66 WeakPolarHBondContact CD1-O 3.46Å; L64-P73 HydrophobicContact CB-CG 4.46Å; L64-P73 HydrophobicContact CD2-CG 4.08Å; L64-P73 HydrophobicContact CG-CG 4.01Å
65	V	98.4	Very high	97.5	Very high	1 Å²	1	65.9 Å²	65.9	1%	0.006	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-34.9	178.4	-63	0	0	0	0	112.8	W53 Q55 V63 P73 I76 F80 L91	W53-V65 HydrophobicContact CB-CG2 3.71Å; W53-V65 VanDerWaalsContact O-CG2 3.29Å; W53-V65 WeakPolarHBondContact O-CG2 3.5Å; W53-V65 PolarHBondContact O-N 3.46Å; Q55-V65 HydrophobicContact CB-CG1 3.64Å; V63-V65 PolarHBondContact O-N 2.78Å; V65-P73 VanDerWaalsContact O-CD 3.25Å; V65-P73 WeakPolarHBondContact O-CD 3.32Å; V65-I76 HydrophobicContact CB-CG2 4.21Å; V65-I76 HydrophobicContact CG1-CD1 4.22Å; V65-I76 HydrophobicContact CG1-CG2 4.47Å; V65-F80 HydrophobicContact CB-CD1 4.49Å; V65-L91 HydrophobicContact CG2-CD1 4.34Å; V65-L91 HydrophobicContact CG2-CD2 4.33Å
66	I	98.6	Very high	97.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.1	173.3	-60.4	-60.7	0	0	0	108.9	Y52 W53 L64 K71 R72 L91	Y52-I66 CarbonylContact C-O 3.57Å; Y52-I66 WeakPolarHBondContact CA-O 3.48Å; W53-I66 HydrophobicContact CB-CB 4.07Å; W53-I66 HydrophobicContact CG-CB 4.38Å; W53-I66 PolarHBondContact N-O 3.46Å; W53-I66 PolarHBondContact O-N 3.46Å; L64-I66 WeakPolarHBondContact CD1-O 3.46Å; I66-K71 CarbonylContact C-O 3.49Å; I66-K71 VanDerWaalsContact CA-O 3.28Å; I66-K71 WeakPolarHBondContact CA-O 3.36Å; I66-R72 HydrophobicContact CD1-CB 4.1Å; I66-R72 HydrophobicContact CD1-CG 4.4Å; I66-L91 HydrophobicContact CG1-CD1 3.58Å
67	Y	97.5	Very high	97.4	Very high	76 Å²	76	65.9 Å²	65.9	30%	0.298	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-132.6	159.2	172.4	72.5	-78.6	0	0	0	110.4	D69 S70 K71 P73	Y67-D69 VanDerWaalsContact C-N 3.26Å; Y67-D69 PolarHBondContact O-N 2.77Å; Y67-S70 PolarHBondContact O-N 2.85Å; Y67-K71 HydrophobicContact CD1-CB 3.74Å; Y67-K71 VanDerWaalsContact CD1-O 3.3Å; Y67-K71 WeakPolarHBondContact CD1-O 3.35Å; Y67-K71 HydrophobicContact CD2-CB 4.04Å; Y67-K71 HydrophobicContact CD2-CD 4.29Å; Y67-K71 HydrophobicContact CE1-CB 3.36Å; Y67-K71 HydrophobicContact CE2-CB 3.69Å; Y67-K71 HydrophobicContact CE2-CD 3.54Å; Y67-K71 HydrophobicContact CE2-CG 4.25Å; Y67-K71 HydrophobicContact CG-CB 4.06Å; Y67-K71 PolarHBondContact N-O 2.9Å; Y67-K71 WeakPolarHBondContact O-CA 3.31Å; Y67-K71 WeakPolarHBondContact O-CB 3.45Å; Y67-K71 PolarHBondContact O-N 2.83Å; Y67-P73 HydrophobicContact CD1-CG 3.95Å; Y67-P73 HydrophobicContact CE1-CG 4.28Å
68	E	96.6	Very high	97.4	Very high	56 Å²	56	70.4 Å²	70.4	26%	0.262	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	49.6	177.8	-68.5	177.4	-154	0	0	112.3	Y50 A51 S70 K71	Y50-E68 HydrophobicContact CD1-CB 4.13Å; Y50-E68 HydrophobicContact CD1-CG 4.38Å; Y50-E68 HydrophobicContact CD2-CB 4.37Å; Y50-E68 HydrophobicContact CD2-CG 3.73Å; Y50-E68 HydrophobicContact CE1-CB 4.4Å; Y50-E68 HydrophobicContact CE2-CG 3.99Å; Y50-E68 HydrophobicContact CG-CB 4.12Å; Y50-E68 HydrophobicContact CG-CG 3.94Å; A51-E68 PolarHBondContact O-N 2.75Å; E68-S70 PolarHBondContact O-N 2.04Å; E68-K71 HydrophobicContact CB-CD 4.07Å; E68-K71 HydrophobicContact CB-CG 4.31Å; E68-K71 VanDerWaalsContact OE2-CE 3.29Å; E68-K71 WeakPolarHBondContact OE2-CE 3.22Å; E68-K71 IonicContact OE2-NZ 3.55Å; E68-K71 PolarHBondContact OE2-NZ 2.82Å
69	D	96.8	Very high	97.5	Very high	36 Å²	36	66.4 Å²	66.4	19%	0.193	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	-40.1	-179.4	-60.5	-42.8	0	0	0	117	Y50 A51 Y67 G82 S83 S84	Y50-D69 WeakPolarHBondContact CD1-OD2 3.19Å; A51-D69 VanDerWaalsContact CB-OD1 3.32Å; A51-D69 WeakPolarHBondContact CB-OD1 3.49Å; A51-D69 PolarHBondContact N-OD1 3.15Å; A51-D69 PolarHBondContact O-N 2.83Å; Y67-D69 VanDerWaalsContact C-N 3.26Å; Y67-D69 PolarHBondContact O-N 2.77Å; D69-G82 CarbonylContact O-C 3.57Å; D69-G82 WeakPolarHBondContact O-CA 2.94Å; D69-S83 PolarHBondContact O-N 3.43Å; D69-S84 VanDerWaalsContact CG-OG 3.26Å; D69-S84 WeakPolarHBondContact OD1-CB 3.29Å; D69-S84 PolarHBondContact OD1-OG 2.7Å
70	S	97.7	Very high	97.7	Very high	80 Å²	80	62.5 Å²	62.5	56%	0.559	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.5	-6.7	-170.3	70.4	0	0	0	0	114.6	Y67 E68	Y67-S70 PolarHBondContact O-N 2.85Å; E68-S70 PolarHBondContact O-N 2.04Å
71	K	98.2	Very high	97.8	Very high	97 Å²	97	59.8 Å²	59.8	42%	0.422	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-81.9	146.1	-179.7	-58	-176.9	-177.9	171.6	0	110	I66 Y67 E68	I66-K71 CarbonylContact C-O 3.49Å; I66-K71 VanDerWaalsContact CA-O 3.28Å; I66-K71 WeakPolarHBondContact CA-O 3.36Å; Y67-K71 HydrophobicContact CD1-CB 3.74Å; Y67-K71 VanDerWaalsContact CD1-O 3.3Å; Y67-K71 WeakPolarHBondContact CD1-O 3.35Å; Y67-K71 HydrophobicContact CD2-CB 4.04Å; Y67-K71 HydrophobicContact CD2-CD 4.29Å; Y67-K71 HydrophobicContact CE1-CB 3.36Å; Y67-K71 HydrophobicContact CE2-CB 3.69Å; Y67-K71 HydrophobicContact CE2-CD 3.54Å; Y67-K71 HydrophobicContact CE2-CG 4.25Å; Y67-K71 HydrophobicContact CG-CB 4.06Å; Y67-K71 PolarHBondContact N-O 2.9Å; Y67-K71 WeakPolarHBondContact O-CA 3.31Å; Y67-K71 WeakPolarHBondContact O-CB 3.45Å; Y67-K71 PolarHBondContact O-N 2.83Å; E68-K71 HydrophobicContact CB-CD 4.07Å; E68-K71 HydrophobicContact CB-CG 4.31Å; E68-K71 VanDerWaalsContact OE2-CE 3.29Å; E68-K71 WeakPolarHBondContact OE2-CE 3.22Å; E68-K71 IonicContact OE2-NZ 3.55Å; E68-K71 PolarHBondContact OE2-NZ 2.82Å
72	R	97.9	Very high	97.8	Very high	67 Å²	67	56.7 Å²	56.7	25%	0.253	33%	0.33	S	S	.	.			trans	-122.4	128.2	-175.5	-179.5	170.8	52.5	-139.6	-11.8	109.9	I66 I76 P77 E78 F80	I66-R72 HydrophobicContact CD1-CB 4.1Å; I66-R72 HydrophobicContact CD1-CG 4.4Å; R72-I76 WeakPolarHBondContact CD-O 3.45Å; R72-I76 HydrophobicContact CG-CB 3.52Å; R72-I76 HydrophobicContact CG-CG1 4.34Å; R72-I76 HydrophobicContact CG-CG2 3.71Å; R72-P77 WeakPolarHBondContact CD-O 3.4Å; R72-P77 PolarHBondContact NH1-O 2.82Å; R72-E78 IonicContact CZ-OE1 3.2Å; R72-E78 IonicContact CZ-OE2 2.69Å; R72-E78 IonicContact NE-OE1 2.64Å; R72-E78 PolarHBondContact NH1-O 3.03Å; R72-E78 IonicContact NH1-OE2 3.21Å; R72-E78 IonicContact NH2-OE1 3.91Å; R72-E78 PolarHBondContact NH2-OE1 3.14Å; R72-E78 IonicContact NH2-OE2 2.76Å; R72-E78 PolarHBondContact NH2-OE2 3.2Å; R72-F80 PolarHBondContact NH1-O 2.98Å
73	P	97.9	Very high	97.8	Very high	35 Å²	35	55.8 Å²	55.8	23%	0.227	33%	0.326	C	S	.	.			trans	-62	157.7	175.5	-22.9	35.6	0	0	0	112.2	L64 V65 Y67 I76	L64-P73 HydrophobicContact CB-CG 4.46Å; L64-P73 HydrophobicContact CD2-CG 4.08Å; L64-P73 HydrophobicContact CG-CG 4.01Å; V65-P73 VanDerWaalsContact O-CD 3.25Å; V65-P73 WeakPolarHBondContact O-CD 3.32Å; Y67-P73 HydrophobicContact CD1-CG 3.95Å; Y67-P73 HydrophobicContact CE1-CG 4.28Å; P73-I76 HydrophobicContact CB-CG1 4.2Å; P73-I76 HydrophobicContact CG-CG1 4.43Å; P73-I76 PolarHBondContact O-N 3.19Å
74	S	97.5	Very high	97.7	Very high	124 Å²	124	54.6 Å²	54.6	87%	0.867	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	137.9	175	58.9	0	0	0	0	111.3	I76	S74-I76 VanDerWaalsContact C-N 3.35Å
75	G	96.9	Very high	97.6	Very high	80 Å²	80	56.5 Å²	56.5	83%	0.825	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-10.2	-179.7	0	0	0	0	0	114.5
76	I	97.6	Very high	97.4	Very high	30 Å²	30	59 Å²	59	15%	0.154	36%	0.363	C	S	.	.	S	Bend	trans	-81.7	130.9	171	-54.1	-56.7	0	0	0	109.1	V63 V65 R72 P73 S74 F80	V63-I76 HydrophobicContact CG1-CD1 4.39Å; V65-I76 HydrophobicContact CB-CG2 4.21Å; V65-I76 HydrophobicContact CG1-CD1 4.22Å; V65-I76 HydrophobicContact CG1-CG2 4.47Å; R72-I76 WeakPolarHBondContact CD-O 3.45Å; R72-I76 HydrophobicContact CG-CB 3.52Å; R72-I76 HydrophobicContact CG-CG1 4.34Å; R72-I76 HydrophobicContact CG-CG2 3.71Å; P73-I76 HydrophobicContact CB-CG1 4.2Å; P73-I76 HydrophobicContact CG-CG1 4.43Å; P73-I76 PolarHBondContact O-N 3.19Å; S74-I76 VanDerWaalsContact C-N 3.35Å; I76-F80 HydrophobicContact CG2-CB 4.06Å; I76-F80 HydrophobicContact CG2-CD2 4.13Å; I76-F80 HydrophobicContact CG2-CG 4.14Å
77	P	97.6	Very high	97.2	Very high	50 Å²	50	61.9 Å²	61.9	33%	0.325	38%	0.381	S	S	.	.			trans	-61.3	148.8	-176	-26.1	35.5	0	0	0	114.4	R72 R79 F80	R72-P77 WeakPolarHBondContact CD-O 3.4Å; R72-P77 PolarHBondContact NH1-O 2.82Å; P77-R79 HydrophobicContact CB-CG 4.12Å; P77-R79 PolarHBondContact O-N 3.27Å; P77-F80 HydrophobicContact CB-CD2 4.27Å; P77-F80 HydrophobicContact CG-CD2 4.46Å; P77-F80 HydrophobicContact CG-CE2 4.4Å; P77-F80 PolarHBondContact O-N 2.77Å; P77-F80 VanDerWaalsContact O-N 3.15Å
78	E	97.6	Very high	97.2	Very high	156 Å²	156	63.3 Å²	63.3	73%	0.729	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-20.3	179.4	-73.8	-63.6	131.1	0	0	114.2	R72 F80	R72-E78 IonicContact CZ-OE1 3.2Å; R72-E78 IonicContact CZ-OE2 2.69Å; R72-E78 IonicContact NE-OE1 2.64Å; R72-E78 PolarHBondContact NH1-O 3.03Å; R72-E78 IonicContact NH1-OE2 3.21Å; R72-E78 IonicContact NH2-OE1 3.91Å; R72-E78 PolarHBondContact NH2-OE1 3.14Å; R72-E78 IonicContact NH2-OE2 2.76Å; R72-E78 PolarHBondContact NH2-OE2 3.2Å; E78-F80 VanDerWaalsContact C-N 3.29Å; E78-F80 PolarHBondContact O-N 3.2Å
79	R	98.2	Very high	97.2	Very high	44 Å²	44	60.7 Å²	60.7	17%	0.166	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.8	-178.8	81.4	-179.7	167.9	-104.4	8.7	114.7	P77 I93 S94 E99 D100	P77-R79 HydrophobicContact CB-CG 4.12Å; P77-R79 PolarHBondContact O-N 3.27Å; R79-I93 HydrophobicContact CG-CG2 4.15Å; R79-S94 WeakPolarHBondContact CA-OG 3.25Å; R79-S94 VanDerWaalsContact CB-O 3.29Å; R79-S94 WeakPolarHBondContact CB-O 3.47Å; R79-S94 PolarHBondContact O-N 3.47Å; R79-S94 PolarHBondContact O-OG 3.1Å; R79-E99 IonicContact NH2-OE2 2.97Å; R79-E99 PolarHBondContact NH2-OE2 3.03Å; R79-D100 IonicContact CZ-OD1 3.64Å; R79-D100 IonicContact CZ-OD2 3.54Å; R79-D100 IonicContact NE-OD1 3.35Å; R79-D100 PolarHBondContact NE-OD1 3.07Å; R79-D100 IonicContact NE-OD2 2.62Å; R79-D100 PolarHBondContact NE-OD2 3.25Å; R79-D100 IonicContact NH2-OD1 3.57Å; R79-D100 PolarHBondContact NH2-OD1 3.27Å; R79-D100 IonicContact NH2-OD2 3.86Å
80	F	98.5	Very high	97.3	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.018	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	124.6	179.3	-74.1	-97.2	0	0	0	110.9	V65 R72 I76 P77 E78 L91 T92 I93 D100 Y104	V65-F80 HydrophobicContact CB-CD1 4.49Å; R72-F80 PolarHBondContact NH1-O 2.98Å; I76-F80 HydrophobicContact CG2-CB 4.06Å; I76-F80 HydrophobicContact CG2-CD2 4.13Å; I76-F80 HydrophobicContact CG2-CG 4.14Å; P77-F80 HydrophobicContact CB-CD2 4.27Å; P77-F80 HydrophobicContact CG-CD2 4.46Å; P77-F80 HydrophobicContact CG-CE2 4.4Å; P77-F80 PolarHBondContact O-N 2.77Å; P77-F80 VanDerWaalsContact O-N 3.15Å; E78-F80 VanDerWaalsContact C-N 3.29Å; E78-F80 PolarHBondContact O-N 3.2Å; F80-L91 HydrophobicContact CD1-CD1 4.38Å; F80-T92 CarbonylContact C-O 3.56Å; F80-T92 WeakPolarHBondContact CA-O 3.21Å; F80-I93 HydrophobicContact CD1-CD1 4.13Å; F80-I93 HydrophobicContact CD1-CG1 3.76Å; F80-I93 HydrophobicContact CD1-CG2 4.4Å; F80-I93 HydrophobicContact CE1-CB 4.5Å; F80-I93 HydrophobicContact CE1-CD1 3.51Å; F80-I93 HydrophobicContact CE1-CG1 3.65Å; F80-I93 HydrophobicContact CE1-CG2 4.09Å; F80-I93 HydrophobicContact CE2-CG2 4.3Å; F80-I93 HydrophobicContact CZ-CD1 4.19Å; F80-I93 HydrophobicContact CZ-CG1 4.42Å; F80-I93 HydrophobicContact CZ-CG2 4.03Å; F80-D100 VanDerWaalsContact CZ-OD1 3.22Å; F80-D100 WeakPolarHBondContact CZ-OD1 2.92Å; F80-Y104 AromaticContact CE1-CE1 3.98Å; F80-Y104 HydrophobicContact CE1-CE1 3.98Å
81	S	98.5	Very high	97.3	Very high	54 Å²	54	56 Å²	56	38%	0.378	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.7	176.1	53.7	0	0	0	0	110.9	T92	S81-T92 PolarHBondContact N-O 2.98Å; S81-T92 PolarHBondContact O-N 3.38Å; S81-T92 WeakPolarHBondContact OG-CB 3.49Å; S81-T92 PolarHBondContact OG-O 3.25Å
82	G	98.4	Very high	97.4	Very high	11 Å²	11	52.1 Å²	52.1	11%	0.113	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	153.9	173.9	0	0	0	0	0	111.9	D69 T90	D69-G82 CarbonylContact O-C 3.57Å; D69-G82 WeakPolarHBondContact O-CA 2.94Å; G82-T90 WeakPolarHBondContact CA-O 3.39Å
83	S	97.8	Very high	97.4	Very high	51 Å²	51	49.1 Å²	49.1	36%	0.357	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.3	172.4	56.2	0	0	0	0	109.9	D69 A89 T90	D69-S83 PolarHBondContact O-N 3.43Å; S83-A89 CarbonylContact O-C 3.53Å; S83-A89 WeakPolarHBondContact O-CA 3.37Å; S83-T90 PolarHBondContact N-O 2.62Å; S83-T90 PolarHBondContact O-N 2.81Å; S83-T90 PolarHBondContact OG-O 2.76Å
84	S	95.9	Very high	97.4	Very high	44 Å²	44	50 Å²	50	31%	0.308	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.5	176.2	-62.1	0	0	0	0	109.9	D69 M88	D69-S84 VanDerWaalsContact CG-OG 3.26Å; D69-S84 WeakPolarHBondContact OD1-CB 3.29Å; D69-S84 PolarHBondContact OD1-OG 2.7Å; S84-M88 CarbonylContact C-O 3.58Å; S84-M88 WeakPolarHBondContact CA-O 3.35Å
85	S	95.2	Very high	97.5	Very high	90 Å²	90	45.6 Å²	45.6	63%	0.629	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150	116.3	177.2	-171.3	0	0	0	0	110	T87 M88	S85-T87 PolarHBondContact O-N 3.28Å; S85-M88 PolarHBondContact N-O 3.37Å; S85-M88 PolarHBondContact O-N 3.26Å
86	G	94	Very high	97.5	Very high	53 Å²	53	42.2 Å²	42.2	55%	0.546	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	-125.7	-176	0	0	0	0	0	111.3	P47 M88	P47-G86 WeakPolarHBondContact CG-O 3.24Å; G86-M88 VanDerWaalsContact C-N 3.27Å; G86-M88 PolarHBondContact O-N 2.85Å
87	T	94.8	Very high	97.5	Very high	61 Å²	61	45.1 Å²	45.1	37%	0.374	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	17.6	178.9	53.9	0	0	0	0	113.2	S42 G43 L46 P47 S85	S42-T87 CarbonylContact C-O 3.6Å; S42-T87 WeakPolarHBondContact CA-O 3.42Å; G43-T87 PolarHBondContact N-O 2.82Å; L46-T87 WeakPolarHBondContact CD1-O 3.35Å; P47-T87 HydrophobicContact CG-CG2 3.66Å; S85-T87 PolarHBondContact O-N 3.28Å
88	M	96.9	Very high	97.4	Very high	107 Å²	107	48 Å²	48	53%	0.527	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132.5	-178.3	-70.9	-179.3	-69.7	0	0	111.8	C41 S84 S85 G86	C41-M88 CarbonylContact O-C 3.58Å; C41-M88 VanDerWaalsContact O-CA 3.31Å; C41-M88 WeakPolarHBondContact O-CA 3.14Å; S84-M88 CarbonylContact C-O 3.58Å; S84-M88 WeakPolarHBondContact CA-O 3.35Å; S85-M88 PolarHBondContact N-O 3.37Å; S85-M88 PolarHBondContact O-N 3.26Å; G86-M88 VanDerWaalsContact C-N 3.27Å; G86-M88 PolarHBondContact O-N 2.85Å
89	A	97.5	Very high	97.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	148.6	166.6	0	0	0	0	0	109.6	T40 C41 L46 A51 W53 S83	T40-A89 CarbonylContact C-O 3.55Å; T40-A89 WeakPolarHBondContact CA-O 3.4Å; C41-A89 HydrophobicContact CB-CB 4.31Å; C41-A89 PolarHBondContact N-O 3.33Å; C41-A89 PolarHBondContact O-N 2.84Å; L46-A89 HydrophobicContact CD1-CB 4Å; L46-A89 HydrophobicContact CD2-CB 4.39Å; A51-A89 HydrophobicContact CB-CB 3.62Å; W53-A89 HydrophobicContact CZ2-CB 4.29Å; S83-A89 CarbonylContact O-C 3.53Å; S83-A89 WeakPolarHBondContact O-CA 3.37Å
90	T	98.5	Very high	97.3	Very high	18 Å²	18	43.2 Å²	43.2	11%	0.11	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	123.7	178.2	-56.6	0	0	0	0	110.6	R38 I39 T40 G82 S83	R38-T90 HydrophobicContact CB-CG2 4.25Å; I39-T90 CarbonylContact O-C 3.55Å; I39-T90 VanDerWaalsContact O-CA 3.3Å; I39-T90 WeakPolarHBondContact O-CA 3.41Å; T40-T90 HydrophobicContact CG2-CG2 4.42Å; G82-T90 WeakPolarHBondContact CA-O 3.39Å; S83-T90 PolarHBondContact N-O 2.62Å; S83-T90 PolarHBondContact O-N 2.81Å; S83-T90 PolarHBondContact OG-O 2.76Å
91	L	98.8	Very high	97.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	127.6	162.4	-177.9	67	0	0	0	109.1	R38 I39 W53 V65 I66 F80 I93 Y104	R38-L91 CarbonylContact C-O 3.5Å; R38-L91 WeakPolarHBondContact CA-O 3.38Å; I39-L91 HydrophobicContact CB-CB 4.41Å; I39-L91 HydrophobicContact CD1-CD2 4.43Å; I39-L91 PolarHBondContact N-O 2.86Å; I39-L91 PolarHBondContact O-N 3.16Å; W53-L91 HydrophobicContact CB-CD1 4.27Å; W53-L91 HydrophobicContact CB-CD2 4.31Å; W53-L91 HydrophobicContact CD2-CB 3.54Å; W53-L91 HydrophobicContact CD2-CD2 4.14Å; W53-L91 HydrophobicContact CD2-CG 4.28Å; W53-L91 HydrophobicContact CE3-CB 3.73Å; W53-L91 HydrophobicContact CE3-CD2 3.89Å; W53-L91 HydrophobicContact CE3-CG 4.4Å; W53-L91 HydrophobicContact CG-CB 4.03Å; W53-L91 HydrophobicContact CG-CD1 4.15Å; W53-L91 HydrophobicContact CG-CD2 4.34Å; W53-L91 HydrophobicContact CG-CG 4.42Å; W53-L91 HydrophobicContact CH2-CB 4.05Å; W53-L91 HydrophobicContact CZ2-CB 3.88Å; W53-L91 HydrophobicContact CZ3-CB 3.98Å; V65-L91 HydrophobicContact CG2-CD1 4.34Å; V65-L91 HydrophobicContact CG2-CD2 4.33Å; I66-L91 HydrophobicContact CG1-CD1 3.58Å; F80-L91 HydrophobicContact CD1-CD1 4.38Å; L91-I93 HydrophobicContact CD2-CD1 4.48Å; L91-I93 HydrophobicContact CG-CG1 4.36Å; L91-Y104 HydrophobicContact CD2-CD1 3.51Å; L91-Y104 HydrophobicContact CD2-CE1 3.9Å; L91-Y104 HydrophobicContact CD2-CG 4.29Å
92	T	98.6	Very high	97.2	Very high	16 Å²	16	49.6 Å²	49.6	10%	0.098	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.2	176.2	-57.9	0	0	0	0	109.4	T36 A37 R38 F80 S81	T36-T92 HydrophobicContact CG2-CG2 3.54Å; A37-T92 WeakPolarHBondContact O-CA 3.46Å; R38-T92 HydrophobicContact CG-CG2 4.43Å; F80-T92 CarbonylContact C-O 3.56Å; F80-T92 WeakPolarHBondContact CA-O 3.21Å; S81-T92 PolarHBondContact N-O 2.98Å; S81-T92 PolarHBondContact O-N 3.38Å; S81-T92 WeakPolarHBondContact OG-CB 3.49Å; S81-T92 PolarHBondContact OG-O 3.25Å
93	I	98.6	Very high	97.2	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	101.4	174.8	-46.8	174.4	0	0	0	106.8	T36 A37 R79 F80 L91 Y104	T36-I93 CarbonylContact C-O 3.59Å; T36-I93 WeakPolarHBondContact CA-O 3.14Å; A37-I93 HydrophobicContact CB-CB 4.27Å; A37-I93 PolarHBondContact N-O 2.88Å; A37-I93 PolarHBondContact O-N 2.66Å; R79-I93 HydrophobicContact CG-CG2 4.15Å; F80-I93 HydrophobicContact CD1-CD1 4.13Å; F80-I93 HydrophobicContact CD1-CG1 3.76Å; F80-I93 HydrophobicContact CD1-CG2 4.4Å; F80-I93 HydrophobicContact CE1-CB 4.5Å; F80-I93 HydrophobicContact CE1-CD1 3.51Å; F80-I93 HydrophobicContact CE1-CG1 3.65Å; F80-I93 HydrophobicContact CE1-CG2 4.09Å; F80-I93 HydrophobicContact CE2-CG2 4.3Å; F80-I93 HydrophobicContact CZ-CD1 4.19Å; F80-I93 HydrophobicContact CZ-CG1 4.42Å; F80-I93 HydrophobicContact CZ-CG2 4.03Å; L91-I93 HydrophobicContact CD2-CD1 4.48Å; L91-I93 HydrophobicContact CG-CG1 4.36Å; I93-Y104 HydrophobicContact CD1-CE1 3.91Å; I93-Y104 HydrophobicContact CD1-CE2 4.25Å; I93-Y104 WeakPolarHBondContact CD1-OH 3.28Å
94	S	98.5	Very high	97.2	Very high	53 Å²	53	52.3 Å²	52.3	37%	0.371	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	140.9	177	56.6	0	0	0	0	110.4	R79 A96	R79-S94 WeakPolarHBondContact CA-OG 3.25Å; R79-S94 VanDerWaalsContact CB-O 3.29Å; R79-S94 WeakPolarHBondContact CB-O 3.47Å; R79-S94 PolarHBondContact O-N 3.47Å; R79-S94 PolarHBondContact O-OG 3.1Å; S94-A96 PolarHBondContact O-N 3.27Å
95	G	98.2	Very high	97.3	Very high	31 Å²	31	55.1 Å²	55.1	32%	0.32	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	50.3	178.4	0	0	0	0	0	113.3	Q35 Q97	Q35-G95 PolarHBondContact O-N 3.21Å; G95-Q97 VanDerWaalsContact O-CG 3.26Å; G95-Q97 WeakPolarHBondContact O-CG 3.21Å; G95-Q97 PolarHBondContact O-N 3.15Å
96	A	98.2	Very high	97.4	Very high	10 Å²	10	51.5 Å²	51.5	8%	0.083	29%	0.291	C	S	.	.			trans	-49.4	134.8	-175.9	0	0	0	0	0	111.8	V31 P33 G34 Q35 S94	V31-A96 HydrophobicContact CG2-CB 3.68Å; P33-A96 CarbonylContact C-O 3.59Å; P33-A96 WeakPolarHBondContact CA-O 3.34Å; G34-A96 PolarHBondContact N-O 2.69Å; Q35-A96 WeakPolarHBondContact O-CB 3.21Å; Q35-A96 PolarHBondContact O-N 2.87Å; S94-A96 PolarHBondContact O-N 3.27Å
97	Q	97.8	Very high	97.4	Very high	91 Å²	91	54.6 Å²	54.6	43%	0.425	29%	0.287	S	S	.	.			trans	-115.5	167	-176.7	-50.2	-172.2	-20.3	0	0	110.4	G95 E99 D100	G95-Q97 VanDerWaalsContact O-CG 3.26Å; G95-Q97 WeakPolarHBondContact O-CG 3.21Å; G95-Q97 PolarHBondContact O-N 3.15Å; Q97-E99 VanDerWaalsContact CB-CD 3.49Å; Q97-E99 WeakPolarHBondContact CB-OE1 3.38Å; Q97-E99 WeakPolarHBondContact CB-OE2 3.37Å; Q97-E99 PolarHBondContact O-N 3.28Å; Q97-E99 PolarHBondContact OE1-OE2 3.11Å; Q97-D100 PolarHBondContact N-OD2 3.32Å; Q97-D100 WeakPolarHBondContact O-CB 3.35Å; Q97-D100 PolarHBondContact O-N 3.04Å
98	V	95.8	Very high	97.3	Very high	109 Å²	109	52.3 Å²	52.3	66%	0.661	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-63.4	-33.7	-178.7	177.3	0	0	0	0	110.5	D100 E101	V98-D100 PolarHBondContact O-N 2.96Å; V98-E101 PolarHBondContact O-N 2.9Å
99	E	95.6	Very high	96.6	Very high	88 Å²	88	49.4 Å²	49.4	41%	0.411	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-71.9	-6	177.1	-13	69.6	-124.2	0	0	114.2	K57 R79 Q97 E101	K57-E99 WeakPolarHBondContact CE-O 3.32Å; K57-E99 PolarHBondContact NZ-O 2.8Å; R79-E99 IonicContact NH2-OE2 2.97Å; R79-E99 PolarHBondContact NH2-OE2 3.03Å; Q97-E99 VanDerWaalsContact CB-CD 3.49Å; Q97-E99 WeakPolarHBondContact CB-OE1 3.38Å; Q97-E99 WeakPolarHBondContact CB-OE2 3.37Å; Q97-E99 PolarHBondContact O-N 3.28Å; Q97-E99 PolarHBondContact OE1-OE2 3.11Å; E99-E101 VanDerWaalsContact C-N 3.32Å
100	D	97.2	Very high	95.3	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.064	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-85.6	-4.6	175.3	-62.6	-33.7	0	0	0	112.6	R79 F80 Q97 V98 A102 Y104	R79-D100 IonicContact CZ-OD1 3.64Å; R79-D100 IonicContact CZ-OD2 3.54Å; R79-D100 IonicContact NE-OD1 3.35Å; R79-D100 PolarHBondContact NE-OD1 3.07Å; R79-D100 IonicContact NE-OD2 2.62Å; R79-D100 PolarHBondContact NE-OD2 3.25Å; R79-D100 IonicContact NH2-OD1 3.57Å; R79-D100 PolarHBondContact NH2-OD1 3.27Å; R79-D100 IonicContact NH2-OD2 3.86Å; F80-D100 VanDerWaalsContact CZ-OD1 3.22Å; F80-D100 WeakPolarHBondContact CZ-OD1 2.92Å; Q97-D100 PolarHBondContact N-OD2 3.32Å; Q97-D100 WeakPolarHBondContact O-CB 3.35Å; Q97-D100 PolarHBondContact O-N 3.04Å; V98-D100 PolarHBondContact O-N 2.96Å; D100-A102 PolarHBondContact O-N 3.05Å; D100-A102 VanDerWaalsContact O-N 3.16Å; D100-Y104 WeakPolarHBondContact O-CE2 3.47Å; D100-Y104 PolarHBondContact O-OH 2.82Å
101	E	97.3	Very high	93.4	Very high	166 Å²	166	54.7 Å²	54.7	78%	0.776	29%	0.294	S	S	*	.			trans	-66.9	110	172.6	-170.4	175.7	168.3	0	0	110.3	V98 E99	V98-E101 PolarHBondContact O-N 2.9Å; E99-E101 VanDerWaalsContact C-N 3.32Å
102	A	98	Very high	91.4	Very high	27 Å²	27	59.2 Å²	59.2	22%	0.223	33%	0.325	C	S	.	.	S	Bend	trans	-166	164.4	-173.1	0	0	0	0	0	110.5	Q55 Q56 K57 D100 Y104	Q55-A102 HydrophobicContact CG-CB 3.44Å; Q55-A102 VanDerWaalsContact CG-CB 3.44Å; Q56-A102 WeakPolarHBondContact O-CB 3.32Å; K57-A102 HydrophobicContact CG-CB 4.09Å; D100-A102 PolarHBondContact O-N 3.05Å; D100-A102 VanDerWaalsContact O-N 3.16Å; A102-Y104 HydrophobicContact CB-CD2 4.46Å; A102-Y104 HydrophobicContact CB-CE2 3.91Å; A102-Y104 VanDerWaalsContact O-CD2 3.29Å; A102-Y104 WeakPolarHBondContact O-CD2 3.38Å; A102-Y104 WeakPolarHBondContact O-CE2 3.38Å
103	D	98.1	Very high	88.9	Confident	94 Å²	94	60.3 Å²	60.3	50%	0.503	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	135.5	162.3	-61.6	-45.1	0	0	0	109	Q56 Y105	Q56-D103 HydrophobicContact CB-CB 4.42Å; Q56-D103 PolarHBondContact N-O 3.49Å; Q56-D103 PolarHBondContact O-N 2.81Å; D103-Y105 HydrophobicContact CB-CE2 3.63Å; D103-Y105 WeakPolarHBondContact CB-OH 3.41Å
104	Y	98.4	Very high	86	Confident	25 Å²	25	68.1 Å²	68.1	10%	0.098	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.4	178.2	-69.6	-90.9	0	0	0	110.2	Q25 I39 Y54 Q55 F80 L91 I93 D100 A102	Q25-Y104 PolarHBondContact NE2-O 2.87Å; I39-Y104 HydrophobicContact CD1-CD1 4.26Å; I39-Y104 HydrophobicContact CD1-CD2 3.51Å; I39-Y104 HydrophobicContact CD1-CE2 4.17Å; I39-Y104 HydrophobicContact CD1-CG 3.55Å; Y54-Y104 CarbonylContact O-C 2.99Å; Y54-Y104 WeakPolarHBondContact O-CA 3.3Å; Q55-Y104 HydrophobicContact CB-CD1 4.15Å; Q55-Y104 HydrophobicContact CB-CE1 3.85Å; Q55-Y104 HydrophobicContact CG-CD1 4.33Å; Q55-Y104 HydrophobicContact CG-CE1 3.73Å; Q55-Y104 PolarHBondContact NE2-OH 3.42Å; F80-Y104 AromaticContact CE1-CE1 3.98Å; F80-Y104 HydrophobicContact CE1-CE1 3.98Å; L91-Y104 HydrophobicContact CD2-CD1 3.51Å; L91-Y104 HydrophobicContact CD2-CE1 3.9Å; L91-Y104 HydrophobicContact CD2-CG 4.29Å; I93-Y104 HydrophobicContact CD1-CE1 3.91Å; I93-Y104 HydrophobicContact CD1-CE2 4.25Å; I93-Y104 WeakPolarHBondContact CD1-OH 3.28Å; D100-Y104 WeakPolarHBondContact O-CE2 3.47Å; D100-Y104 PolarHBondContact O-OH 2.82Å; A102-Y104 HydrophobicContact CB-CD2 4.46Å; A102-Y104 HydrophobicContact CB-CE2 3.91Å; A102-Y104 VanDerWaalsContact O-CD2 3.29Å; A102-Y104 WeakPolarHBondContact O-CD2 3.38Å; A102-Y104 WeakPolarHBondContact O-CE2 3.38Å
105	Y	97.6	Very high	83.2	Confident	102 Å²	102	77.9 Å²	77.9	40%	0.4	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.8	-177.7	-56	-81.5	0	0	0	110.6	W53 Y54 Q56 D103	W53-Y105 CarbonylContact C-O 3.52Å; W53-Y105 WeakPolarHBondContact CA-O 3.29Å; Y54-Y105 PolarHBondContact N-O 2.97Å; Y54-Y105 PolarHBondContact O-N 3.15Å; Q56-Y105 HydrophobicContact CB-CD2 4.4Å; Q56-Y105 HydrophobicContact CB-CE2 3.82Å; Q56-Y105 VanDerWaalsContact OE1-CE2 3.3Å; Q56-Y105 PolarHBondContact OE1-OH 3.05Å; D103-Y105 HydrophobicContact CB-CE2 3.63Å; D103-Y105 WeakPolarHBondContact CB-OH 3.41Å
106	C	97	Very high	82.4	Confident	14 Å²	14	80.3 Å²	80.3	10%	0.095	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	136.7	168.9	178.3	0	0	0	0	108.9	Q25 C41 Y52 W53	Q25-C106 HydrophobicContact CG-CB 4.34Å; C41-C106 HydrophobicContact CB-CB 3.39Å; C41-C106 WeakPolarHBondContact CB-SG 3.36Å; C41-C106 WeakPolarHBondContact SG-CB 3.29Å; C41-C106 CovalentContact SG-SG 2.04Å; C41-C106 PolarHBondContact SG-SG 2.77Å; Y52-C106 CarbonylContact O-C 3.52Å; Y52-C106 WeakPolarHBondContact O-CA 3.38Å; W53-C106 HydrophobicContact CD2-CB 4.44Å; W53-C106 HydrophobicContact CE3-CB 4.2Å; W53-C106 HydrophobicContact CH2-CB 4.06Å; W53-C106 HydrophobicContact CZ2-CB 4.29Å; W53-C106 HydrophobicContact CZ3-CB 4Å
107	Y	94.7	Very high	81.6	Confident	118 Å²	118	83.9 Å²	83.9	46%	0.463	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	144.6	177.4	173	-101.4	0	0	0	110.1	Y52	Y52-Y107 AromaticContact CD2-CD1 3.96Å; Y52-Y107 HydrophobicContact CD2-CD1 3.96Å; Y52-Y107 HydrophobicContact CG-CD1 4.28Å; Y52-Y107 PolarHBondContact N-O 2.64Å; Y52-Y107 PolarHBondContact O-N 3.2Å
108	S	92.6	Very high	80.7	Confident	14 Å²	14	83.6 Å²	83.6	10%	0.098	45%	0.445	C	S	.	.			trans	-143.9	140.7	171.5	174.9	0	0	0	0	107.4	K49	K49-S108 WeakPolarHBondContact CB-OG 3.29Å
109	T	82.6	Confident	79.8	Confident	45 Å²	45	82.1 Å²	82.1	28%	0.276	43%	0.433	S	S	.	.			trans	-66.9	147.3	173.2	-178.2	0	0	0	0	110	K49	K49-T109 HydrophobicContact CB-CG2 3.94Å; K49-T109 HydrophobicContact CD-CG2 3.41Å; K49-T109 VanDerWaalsContact CD-CG2 3.41Å; K49-T109 HydrophobicContact CG-CG2 3.75Å; K49-T109 WeakPolarHBondContact CG-O 3.38Å
110	D	70.3	Confident	78.8	Confident	72 Å²	72	81.7 Å²	81.7	39%	0.385	43%	0.434	S	S	.	.			trans	-69.7	161.2	169.1	66.2	33.6	0	0	0	111	K49 S112 G113	K49-D110 VanDerWaalsContact CE-O 3.24Å; K49-D110 WeakPolarHBondContact CE-O 3.42Å; K49-D110 PolarHBondContact NZ-O 3.34Å; D110-S112 PolarHBondContact O-N 2.99Å; D110-S112 PolarHBondContact OD1-N 3.39Å; D110-S112 PolarHBondContact OD1-OG 3.18Å; D110-S112 PolarHBondContact OD2-OG 3.32Å; D110-S112 VanDerWaalsContact OD2-OG 3.05Å; D110-G113 PolarHBondContact OD1-N 2.95Å
111	S	58.7	Low	77.6	Confident	57 Å²	57	86.3 Å²	86.3	40%	0.399	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-4.2	173.1	59.1	0	0	0	0	113.3	Y21	Y21-S111 WeakPolarHBondContact CE2-OG 3.24Å; Y21-S111 PolarHBondContact OH-OG 3.01Å
112	S	56.2	Low	76.2	Confident	95 Å²	95	80.6 Å²	80.6	66%	0.664	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-8.4	-171.2	29.5	0	0	0	0	114.9	D110 N114	D110-S112 PolarHBondContact O-N 2.99Å; D110-S112 PolarHBondContact OD1-N 3.39Å; D110-S112 PolarHBondContact OD1-OG 3.18Å; D110-S112 PolarHBondContact OD2-OG 3.32Å; D110-S112 VanDerWaalsContact OD2-OG 3.05Å; S112-N114 PolarHBondContact O-N 3.45Å
113	G	46.4	Very low	74.5	Confident	39 Å²	39	84.8 Å²	84.8	40%	0.402	45%	0.452	S	S	.	.			trans	-92.1	93.1	173.8	0	0	0	0	0	114.4	D110 H115	D110-G113 PolarHBondContact OD1-N 2.95Å; G113-H115 PolarHBondContact O-N 3.49Å
114	N	37	Very low	72.5	Confident	168 Å²	168	84 Å²	84	90%	0.898	45%	0.448	S	S	*	.			trans	-66.4	116.7	141.5	-90.1	-8	0	0	0	106.1	S112	S112-N114 PolarHBondContact O-N 3.45Å
115	H	39	Very low	70.2	Confident	259 Å²	259	89.4 Å²	89.4	100%	1.199	48%	0.48	S	S	*	.			trans	-71.4	0	157.3	-81.5	-67.5	0	0	0	109.8	G113	G113-H115 PolarHBondContact O-N 3.49Å

Retrieved 115 of 115 residues in 55.5 ms (Link to these results)

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