A0A077ZJ33_TRITR Loading...

Small ribosomal subunit protein uS13

AlphaFold DB , UniProt , Accession A0A077ZJ33, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 163 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	39.8	Very low	34.5	Very low	238 Å²	238	157.2 Å²	157.2	100%	1.172	78%	0.776	S	S	*	*				0	123.5	0	-74.5	178.1	177	0	0	107.9	N3	M1-N3 PolarHBondContact O-N 3.15Å
2	R	31.2	Very low	34.8	Very low	248 Å²	248	149.3 Å²	149.3	94%	0.936	76%	0.755	S	S	*	*			trans	-51.6	122.1	-167	-73.7	174.8	-166.4	154.3	4.6	112.5	N4	R2-N4 VanDerWaalsContact C-N 3.27Å; R2-N4 PolarHBondContact O-N 2.83Å
3	N	35.4	Very low	35.8	Very low	126 Å²	126	154.5 Å²	154.5	67%	0.674	77%	0.769	S	S	*	*			trans	-65.1	84.2	170.1	-87.9	-20.1	0	0	0	109.5	M1 Y5	M1-N3 PolarHBondContact O-N 3.15Å; N3-Y5 HydrophobicContact CB-CD2 3.69Å; N3-Y5 HydrophobicContact CB-CE2 3.6Å; N3-Y5 VanDerWaalsContact CG-CE2 3.4Å; N3-Y5 PolarHBondContact O-N 2.96Å
4	N	31.3	Very low	35.7	Very low	152 Å²	152	154.1 Å²	154.1	81%	0.813	76%	0.764	S	S	*	*			trans	-83.8	63.5	171.5	-134	-6.7	0	0	0	108	R2 K6	R2-N4 VanDerWaalsContact C-N 3.27Å; R2-N4 PolarHBondContact O-N 2.83Å; N4-K6 PolarHBondContact O-N 3.42Å
5	Y	37.1	Very low	36.1	Very low	157 Å²	157	152.7 Å²	152.7	62%	0.616	76%	0.76	S	S	*	*			trans	-68.4	87.9	161	-65.4	-81.1	0	0	0	104.9	N3 E7	N3-Y5 HydrophobicContact CB-CD2 3.69Å; N3-Y5 HydrophobicContact CB-CE2 3.6Å; N3-Y5 VanDerWaalsContact CG-CE2 3.4Å; N3-Y5 PolarHBondContact O-N 2.96Å; Y5-E7 PolarHBondContact O-N 2.88Å
6	K	36	Very low	36.8	Very low	187 Å²	187	154.4 Å²	154.4	81%	0.813	77%	0.768	S	S	*	*			trans	-58.1	101.9	163.2	-152.6	177.3	-172.3	-174.6	0	104	N4 V8	N4-K6 PolarHBondContact O-N 3.42Å; K6-V8 VanDerWaalsContact C-N 3.34Å; K6-V8 PolarHBondContact O-N 2.84Å
7	E	32	Very low	38.3	Very low	162 Å²	162	153.6 Å²	153.6	76%	0.757	77%	0.766	S	S	*	*			trans	-41.4	108.3	163.9	-82.7	168.4	132.2	0	0	105.7	Y5 L9	Y5-E7 PolarHBondContact O-N 2.88Å; E7-L9 PolarHBondContact O-N 3.3Å
8	V	37.3	Very low	39.5	Very low	113 Å²	113	155.6 Å²	155.6	69%	0.685	77%	0.772	S	S	*	*			trans	-75.5	78.8	154.3	-177	0	0	0	0	102	K6 C10	K6-V8 VanDerWaalsContact C-N 3.34Å; K6-V8 PolarHBondContact O-N 2.84Å; V8-C10 PolarHBondContact O-N 3.48Å
9	L	31	Very low	41.1	Very low	125 Å²	125	152.5 Å²	152.5	65%	0.654	76%	0.757	S	S	*	*			trans	-47.2	112.5	162.5	-110.4	152.9	0	0	0	103.8	E7 V11	E7-L9 PolarHBondContact O-N 3.3Å; L9-V11 PolarHBondContact O-N 2.75Å
10	C	31.4	Very low	42.6	Very low	108 Å²	108	152.8 Å²	152.8	73%	0.73	76%	0.757	S	S	*	*			trans	-55.6	92.5	156.8	-60.2	0	0	0	0	103.6	V8 A12	V8-C10 PolarHBondContact O-N 3.48Å; C10-A12 PolarHBondContact O-N 2.84Å
11	V	37	Very low	44.3	Very low	113 Å²	113	147.2 Å²	147.2	69%	0.685	74%	0.738	S	S	*	*			trans	-58.1	102.1	156.6	-178.2	0	0	0	0	101	L9	L9-V11 PolarHBondContact O-N 2.75Å
12	A	38.2	Very low	46.1	Very low	63 Å²	63	140.6 Å²	140.6	52%	0.521	71%	0.711	S	S	.	*			trans	-45	148.2	164.9	0	0	0	0	0	105.4	C10 E14	C10-A12 PolarHBondContact O-N 2.84Å; A12-E14 HydrophobicContact CB-CG 4.5Å; A12-E14 PolarHBondContact O-N 2.69Å
13	K	47.6	Very low	48.4	Very low	216 Å²	216	132.8 Å²	132.8	94%	0.939	69%	0.691	S	S	*	*			trans	-62.2	84.3	163.5	-71.6	177.6	175.7	-178.7	0	104.9	D15	K13-D15 PolarHBondContact O-N 2.89Å
14	E	34.4	Very low	50.7	Low	149 Å²	149	130 Å²	130	70%	0.696	68%	0.678	S	S	*	*			trans	-62	110.7	177.6	-83.5	178.7	166.2	0	0	103.7	A12	A12-E14 HydrophobicContact CB-CG 4.5Å; A12-E14 PolarHBondContact O-N 2.69Å
15	D	42	Very low	53	Low	133 Å²	133	127.6 Å²	127.6	71%	0.711	66%	0.662	S	S	*	*			trans	61.8	91.4	152.6	-45.7	-28.6	0	0	0	114.3	K13 I17	K13-D15 PolarHBondContact O-N 2.89Å; D15-I17 PolarHBondContact O-N 2.81Å
16	M	46.3	Very low	55	Low	181 Å²	181	125.3 Å²	125.3	89%	0.892	66%	0.664	S	S	*	*			trans	-54.9	108.2	151.3	-74.6	170.8	98.2	0	0	106.5	E18	M16-E18 PolarHBondContact O-N 2.81Å; M16-E18 VanDerWaalsContact O-N 3.17Å
17	I	63.2	Low	57	Low	141 Å²	141	119.3 Å²	119.3	72%	0.723	64%	0.641	S	S	*	*			trans	-77.8	103.5	175.5	-48.8	178.5	0	0	0	106.2	D15 I19	D15-I17 PolarHBondContact O-N 2.81Å; I17-I19 HydrophobicContact CB-CG1 4.38Å; I17-I19 HydrophobicContact CG2-CD1 3.75Å; I17-I19 HydrophobicContact CG2-CG1 3.49Å; I17-I19 VanDerWaalsContact CG2-CG1 3.49Å; I17-I19 PolarHBondContact O-N 3.4Å
18	E	59.4	Low	58.5	Low	189 Å²	189	116.2 Å²	116.2	88%	0.883	64%	0.635	S	S	*	*			trans	-77.6	108.1	171.1	-64.9	-179.8	177.5	0	0	107.4	M16	M16-E18 PolarHBondContact O-N 2.81Å; M16-E18 VanDerWaalsContact O-N 3.17Å
19	I	70.5	Confident	59.9	Low	96 Å²	96	114.7 Å²	114.7	49%	0.492	62%	0.623	S	S	.	*			trans	-120.1	124	174.7	-46.9	179.9	0	0	0	107.1	I17 L36	I17-I19 HydrophobicContact CB-CG1 4.38Å; I17-I19 HydrophobicContact CG2-CD1 3.75Å; I17-I19 HydrophobicContact CG2-CG1 3.49Å; I17-I19 VanDerWaalsContact CG2-CG1 3.49Å; I17-I19 PolarHBondContact O-N 3.4Å; I19-L36 HydrophobicContact CB-CD2 4.22Å; I19-L36 HydrophobicContact CD1-CD1 4.27Å; I19-L36 HydrophobicContact CG2-CD1 4.49Å; I19-L36 HydrophobicContact CG2-CD2 3.75Å; I19-L36 HydrophobicContact CG2-CG 4.5Å
20	E	70.2	Confident	61.6	Low	159 Å²	159	111.3 Å²	111.3	74%	0.743	61%	0.613	S	S	*	*			trans	-71.3	129.1	168.9	-61.8	-168.8	165.4	0	0	108.6
21	G	79.3	Confident	63.2	Low	35 Å²	35	108.9 Å²	108.9	36%	0.361	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-144.6	148.9	-179.2	0	0	0	0	0	110	E35	G21-E35 CarbonylContact C-O 3.55Å; G21-E35 WeakPolarHBondContact CA-O 3.37Å
22	T	77.9	Confident	65.2	Low	99 Å²	99	106.4 Å²	106.4	61%	0.607	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.3	131.7	176.6	36.3	0	0	0	0	109.6	V24 V34 E35	T22-V24 PolarHBondContact O-N 2.88Å; T22-V34 CarbonylContact O-C 3.58Å; T22-V34 WeakPolarHBondContact O-CA 3.33Å; T22-E35 PolarHBondContact N-O 2.98Å; T22-E35 PolarHBondContact O-N 2.84Å; T22-E35 PolarHBondContact OG1-O 2.89Å
23	V	78	Confident	67.1	Low	84 Å²	84	105.7 Å²	105.7	51%	0.509	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.6	111.8	175.7	175.8	0	0	0	0	108.1	T26 F32	V23-T26 HydrophobicContact CG1-CG2 4.46Å; V23-F32 HydrophobicContact CG1-CB 4.18Å; V23-F32 HydrophobicContact CG1-CD1 3.62Å; V23-F32 HydrophobicContact CG1-CG 4.33Å; V23-F32 HydrophobicContact CG2-CB 4.48Å; V23-F32 HydrophobicContact CG2-CD1 4.36Å
24	V	84.3	Confident	68.8	Low	68 Å²	68	96.5 Å²	96.5	41%	0.412	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-48.8	179.4	-172.1	0	0	0	0	110.3	T22 K33 E35	T22-V24 PolarHBondContact O-N 2.88Å; V24-K33 PolarHBondContact N-O 3.36Å; V24-E35 HydrophobicContact CG2-CB 3.41Å; V24-E35 VanDerWaalsContact CG2-CB 3.41Å
25	E	80.3	Confident	70.8	Confident	101 Å²	101	93.2 Å²	93.2	47%	0.472	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.3	-175.5	-70.9	176.9	172.8	0	0	111.7	F32 K33	E25-F32 WeakPolarHBondContact O-CA 3.49Å; E25-K33 HydrophobicContact CB-CB 3.98Å; E25-K33 PolarHBondContact N-O 2.84Å; E25-K33 PolarHBondContact O-N 3.17Å
26	T	78.6	Confident	72.9	Confident	109 Å²	109	88.2 Å²	88.2	67%	0.669	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.5	168.9	54.7	0	0	0	0	108.9	V23 F32	V23-T26 HydrophobicContact CG1-CG2 4.46Å; T26-F32 HydrophobicContact CG2-CD1 3.95Å; T26-F32 HydrophobicContact CG2-CE1 3.85Å
27	L	77.9	Confident	74.4	Confident	62 Å²	62	87.6 Å²	87.6	33%	0.325	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	157.8	178.1	-66.1	174.3	0	0	0	110.3	M31 L43	L27-M31 WeakPolarHBondContact CA-O 3.35Å; L27-M31 HydrophobicContact CB-CB 4Å; L27-M31 HydrophobicContact CB-CE 4.32Å; L27-M31 WeakPolarHBondContact CB-O 3.42Å; L27-M31 HydrophobicContact CD1-CE 4.5Å; L27-M31 PolarHBondContact N-O 2.81Å; L27-L43 HydrophobicContact CD1-CD2 3.5Å; L27-L43 VanDerWaalsContact CD1-CD2 3.5Å
28	P	63.1	Low	75.4	Confident	97 Å²	97	86.9 Å²	86.9	63%	0.63	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	154	170.6	-22.1	32.7	0	0	0	111.2	M31	P28-M31 WeakPolarHBondContact O-CE 3.41Å
29	N	66.5	Low	76.3	Confident	80 Å²	80	80.2 Å²	80.2	43%	0.428	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	28.5	179.3	-40.8	-29	0	0	0	115.1	M31 R53	N29-M31 HydrophobicContact CB-CG 4.49Å; N29-M31 PolarHBondContact O-N 3.27Å; N29-R53 VanDerWaalsContact CG-NH1 3.27Å; N29-R53 PolarHBondContact OD1-NH1 3.08Å
30	A	66.8	Low	76.7	Confident	54 Å²	54	81.3 Å²	81.3	45%	0.446	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	34.4	-179.9	0	0	0	0	0	113.1	V46	A30-V46 PolarHBondContact O-N 3.3Å; A30-V46 VanDerWaalsContact O-N 3.08Å
31	M	66.6	Low	77.1	Confident	57 Å²	57	79 Å²	79	28%	0.281	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	142.4	172.7	-63.7	-172	-48.2	0	0	109.3	L27 P28 N29 A44	L27-M31 WeakPolarHBondContact CA-O 3.35Å; L27-M31 HydrophobicContact CB-CB 4Å; L27-M31 HydrophobicContact CB-CE 4.32Å; L27-M31 WeakPolarHBondContact CB-O 3.42Å; L27-M31 HydrophobicContact CD1-CE 4.5Å; L27-M31 PolarHBondContact N-O 2.81Å; P28-M31 WeakPolarHBondContact O-CE 3.41Å; N29-M31 HydrophobicContact CB-CG 4.49Å; N29-M31 PolarHBondContact O-N 3.27Å; M31-A44 CarbonylContact C-O 3.49Å; M31-A44 VanDerWaalsContact CA-O 3.27Å; M31-A44 WeakPolarHBondContact CA-O 2.95Å
32	F	77.3	Confident	77.2	Confident	61 Å²	61	80.6 Å²	80.6	27%	0.268	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.4	177.9	-59.3	-87.6	0	0	0	108.7	V23 E25 T26 V34 L43 A44 V46	V23-F32 HydrophobicContact CG1-CB 4.18Å; V23-F32 HydrophobicContact CG1-CD1 3.62Å; V23-F32 HydrophobicContact CG1-CG 4.33Å; V23-F32 HydrophobicContact CG2-CB 4.48Å; V23-F32 HydrophobicContact CG2-CD1 4.36Å; E25-F32 WeakPolarHBondContact O-CA 3.49Å; T26-F32 HydrophobicContact CG2-CD1 3.95Å; T26-F32 HydrophobicContact CG2-CE1 3.85Å; F32-V34 HydrophobicContact CB-CG2 3.97Å; F32-V34 PolarHBondContact O-N 2.64Å; F32-L43 CarbonylContact O-C 3.57Å; F32-L43 WeakPolarHBondContact O-CA 3.45Å; F32-A44 HydrophobicContact CB-CB 4.45Å; F32-A44 PolarHBondContact N-O 2.99Å; F32-A44 PolarHBondContact O-N 3.48Å; F32-V46 HydrophobicContact CD2-CG2 3.84Å; F32-V46 HydrophobicContact CE2-CB 4.23Å; F32-V46 HydrophobicContact CE2-CG2 3.41Å; F32-V46 VanDerWaalsContact CE2-CG2 3.41Å; F32-V46 HydrophobicContact CZ-CG2 4.49Å
33	K	79.7	Confident	77.2	Confident	49 Å²	49	81.3 Å²	81.3	21%	0.213	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	106.4	163.8	-158.5	-171.9	-167.1	-155	0	106.6	V24 E25 E41	V24-K33 PolarHBondContact N-O 3.36Å; E25-K33 HydrophobicContact CB-CB 3.98Å; E25-K33 PolarHBondContact N-O 2.84Å; E25-K33 PolarHBondContact O-N 3.17Å; K33-E41 WeakPolarHBondContact CE-OE1 3.48Å; K33-E41 WeakPolarHBondContact CE-OE2 3.27Å; K33-E41 IonicContact NZ-OE1 2.68Å; K33-E41 PolarHBondContact NZ-OE1 3.11Å; K33-E41 IonicContact NZ-OE2 2.92Å; K33-E41 PolarHBondContact NZ-OE2 2.98Å
34	V	81.7	Confident	76.7	Confident	22 Å²	22	79.2 Å²	79.2	13%	0.133	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.3	-178.3	-175.6	0	0	0	0	108	T22 F32 L36 E41 V42 A44	T22-V34 CarbonylContact O-C 3.58Å; T22-V34 WeakPolarHBondContact O-CA 3.33Å; F32-V34 HydrophobicContact CB-CG2 3.97Å; F32-V34 PolarHBondContact O-N 2.64Å; V34-L36 HydrophobicContact CG1-CD2 4.17Å; V34-E41 CarbonylContact O-C 3.58Å; V34-E41 WeakPolarHBondContact O-CA 3.47Å; V34-V42 PolarHBondContact N-O 3.11Å; V34-V42 PolarHBondContact O-N 3.18Å; V34-A44 HydrophobicContact CG2-CB 3.62Å
35	E	77.9	Confident	75.7	Confident	80 Å²	80	80.2 Å²	80.2	37%	0.374	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.2	169.5	-173	169.8	-157.7	0	0	108.3	G21 T22 V24	G21-E35 CarbonylContact C-O 3.55Å; G21-E35 WeakPolarHBondContact CA-O 3.37Å; T22-E35 PolarHBondContact N-O 2.98Å; T22-E35 PolarHBondContact O-N 2.84Å; T22-E35 PolarHBondContact OG1-O 2.89Å; V24-E35 HydrophobicContact CG2-CB 3.41Å; V24-E35 VanDerWaalsContact CG2-CB 3.41Å
36	L	84.8	Confident	74.6	Confident	28 Å²	28	79.5 Å²	79.5	15%	0.147	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	154.2	174.2	-56.3	-178.8	0	0	0	109.2	I19 V34 N38 G39 H40 V42	I19-L36 HydrophobicContact CB-CD2 4.22Å; I19-L36 HydrophobicContact CD1-CD1 4.27Å; I19-L36 HydrophobicContact CG2-CD1 4.49Å; I19-L36 HydrophobicContact CG2-CD2 3.75Å; I19-L36 HydrophobicContact CG2-CG 4.5Å; V34-L36 HydrophobicContact CG1-CD2 4.17Å; L36-N38 PolarHBondContact O-N 3.06Å; L36-G39 PolarHBondContact O-N 3.06Å; L36-H40 HydrophobicContact CD1-CB 4.48Å; L36-H40 PolarHBondContact N-O 2.92Å; L36-V42 HydrophobicContact CD1-CG2 3.65Å; L36-V42 HydrophobicContact CG-CG2 4.04Å
37	E	78.9	Confident	73.5	Confident	168 Å²	168	77 Å²	77	79%	0.785	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-26.4	177.6	-61.2	-171.9	153.7	0	0	113.5	G39	E37-G39 PolarHBondContact O-N 3.37Å; E37-G39 VanDerWaalsContact O-N 3.15Å
38	N	84	Confident	72.5	Confident	126 Å²	126	78.1 Å²	78.1	67%	0.674	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	2.7	175.8	-61.4	-15.2	0	0	0	113.8	L36 H40	L36-N38 PolarHBondContact O-N 3.06Å; N38-H40 VanDerWaalsContact C-N 3.3Å
39	G	77.7	Confident	72.1	Confident	50 Å²	50	77.7 Å²	77.7	52%	0.515	45%	0.448	S	S	.	.	S	Bend	trans	73.9	19	-176	0	0	0	0	0	113.8	L36 E37	L36-G39 PolarHBondContact O-N 3.06Å; E37-G39 PolarHBondContact O-N 3.37Å; E37-G39 VanDerWaalsContact O-N 3.15Å
40	H	80	Confident	71.8	Confident	119 Å²	119	80.8 Å²	80.8	55%	0.551	47%	0.465	S	S	*	.			trans	-99.5	128.4	178.5	-68.3	-50.3	0	0	0	110.7	L36 N38	L36-H40 HydrophobicContact CD1-CB 4.48Å; L36-H40 PolarHBondContact N-O 2.92Å; N38-H40 VanDerWaalsContact C-N 3.3Å
41	E	78.5	Confident	71.9	Confident	109 Å²	109	80.8 Å²	80.8	51%	0.509	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.5	174.2	-57.7	-177.4	141.2	0	0	110.1	K33 V34	K33-E41 WeakPolarHBondContact CE-OE1 3.48Å; K33-E41 WeakPolarHBondContact CE-OE2 3.27Å; K33-E41 IonicContact NZ-OE1 2.68Å; K33-E41 PolarHBondContact NZ-OE1 3.11Å; K33-E41 IonicContact NZ-OE2 2.92Å; K33-E41 PolarHBondContact NZ-OE2 2.98Å; V34-E41 CarbonylContact O-C 3.58Å; V34-E41 WeakPolarHBondContact O-CA 3.47Å
42	V	80.6	Confident	72.2	Confident	70 Å²	70	80 Å²	80	42%	0.424	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.7	179.2	-169.1	0	0	0	0	109.5	V34 L36	V34-V42 PolarHBondContact N-O 3.11Å; V34-V42 PolarHBondContact O-N 3.18Å; L36-V42 HydrophobicContact CD1-CG2 3.65Å; L36-V42 HydrophobicContact CG-CG2 4.04Å
43	L	77.6	Confident	71.9	Confident	114 Å²	114	82.4 Å²	82.4	60%	0.597	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	111.3	173.9	-69.7	169.4	0	0	0	109.7	L27 F32	L27-L43 HydrophobicContact CD1-CD2 3.5Å; L27-L43 VanDerWaalsContact CD1-CD2 3.5Å; F32-L43 CarbonylContact O-C 3.57Å; F32-L43 WeakPolarHBondContact O-CA 3.45Å
44	A	67.2	Low	72	Confident	39 Å²	39	85.7 Å²	85.7	32%	0.322	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.5	175.4	0	0	0	0	0	110.2	M31 F32 V34	M31-A44 CarbonylContact C-O 3.49Å; M31-A44 VanDerWaalsContact CA-O 3.27Å; M31-A44 WeakPolarHBondContact CA-O 2.95Å; F32-A44 HydrophobicContact CB-CB 4.45Å; F32-A44 PolarHBondContact N-O 2.99Å; F32-A44 PolarHBondContact O-N 3.48Å; V34-A44 HydrophobicContact CG2-CB 3.62Å
45	H	64.2	Low	72.2	Confident	89 Å²	89	88.2 Å²	88.2	41%	0.412	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.6	174.3	-179.9	-90.3	0	0	0	109.7	S47	H45-S47 PolarHBondContact CE1-O 3.28Å; H45-S47 PolarHBondContact ND1-O 3.39Å; H45-S47 VanDerWaalsContact ND1-O 3.11Å
46	V	57.6	Low	72.7	Confident	86 Å²	86	90.5 Å²	90.5	52%	0.521	50%	0.498	S	S	.	.	S	Bend	trans	-88.2	123.3	178	176.4	0	0	0	0	110	A30 F32	A30-V46 PolarHBondContact O-N 3.3Å; A30-V46 VanDerWaalsContact O-N 3.08Å; F32-V46 HydrophobicContact CD2-CG2 3.84Å; F32-V46 HydrophobicContact CE2-CB 4.23Å; F32-V46 HydrophobicContact CE2-CG2 3.41Å; F32-V46 VanDerWaalsContact CE2-CG2 3.41Å; F32-V46 HydrophobicContact CZ-CG2 4.49Å
47	S	55.8	Low	72.9	Confident	58 Å²	58	89.3 Å²	89.3	41%	0.406	49%	0.491	S	S	.	.	S	Bend	trans	89.6	108.7	-177.4	90	0	0	0	0	115.1	H45 V49	H45-S47 PolarHBondContact CE1-O 3.28Å; H45-S47 PolarHBondContact ND1-O 3.39Å; H45-S47 VanDerWaalsContact ND1-O 3.11Å; S47-V49 PolarHBondContact O-N 3.42Å
48	G	57	Low	73.4	Confident	85 Å²	85	82 Å²	82	88%	0.876	46%	0.458	S	S	*	.	S	Bend	trans	-78.5	36.7	-170.7	0	0	0	0	0	116
49	V	54.5	Low	73.6	Confident	87 Å²	87	79.9 Å²	79.9	53%	0.527	45%	0.446	S	S	.	.			trans	-129	99	172.5	-168.1	0	0	0	0	109.2	S47 I51 I64	S47-V49 PolarHBondContact O-N 3.42Å; V49-I51 VanDerWaalsContact C-N 3.32Å; V49-I51 HydrophobicContact CG1-CD1 4.22Å; V49-I51 HydrophobicContact CG1-CG1 3.8Å; V49-I51 PolarHBondContact O-N 2.93Å; V49-I64 HydrophobicContact CG1-CD1 4.36Å
50	D	60.4	Low	74.1	Confident	146 Å²	146	77.5 Å²	77.5	78%	0.781	42%	0.422	S	S	*	.			trans	-70.9	85.4	177.4	-68	-50.8	0	0	0	110.5
51	I	68	Low	74.4	Confident	53 Å²	53	72.1 Å²	72.1	27%	0.272	40%	0.397	S	S	.	.			trans	-90.1	126.3	172.3	-57.3	-176.8	0	0	0	108.8	V49 R53 S60 I64 V87	V49-I51 VanDerWaalsContact C-N 3.32Å; V49-I51 HydrophobicContact CG1-CD1 4.22Å; V49-I51 HydrophobicContact CG1-CG1 3.8Å; V49-I51 PolarHBondContact O-N 2.93Å; I51-R53 PolarHBondContact O-N 3.13Å; I51-R53 VanDerWaalsContact O-N 3.13Å; I51-S60 VanDerWaalsContact CG2-CB 3.46Å; I51-I64 HydrophobicContact CD1-CD1 4.2Å; I51-V87 HydrophobicContact CG2-CG1 4.35Å; I51-V87 HydrophobicContact CG2-CG2 4.06Å
52	P	71.8	Confident	75	Confident	42 Å²	42	69 Å²	69	27%	0.273	39%	0.385	S	S	.	.			trans	-57.1	119.2	175.1	-24.4	33.4	0	0	0	111.8	K55 S60 Y63	P52-K55 HydrophobicContact CB-CD 4.1Å; P52-K55 HydrophobicContact CB-CG 4.49Å; P52-S60 PolarHBondContact O-OG 3.39Å; P52-S60 VanDerWaalsContact O-OG 3.07Å; P52-Y63 HydrophobicContact CG-CD2 4.34Å; P52-Y63 HydrophobicContact CG-CG 4.42Å
53	R	73.1	Confident	75.3	Confident	111 Å²	111	72 Å²	72	42%	0.419	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.8	-171.2	-56.9	-172.2	93.9	-159.7	5.3	114.3	N29 I51 R88	N29-R53 VanDerWaalsContact CG-NH1 3.27Å; N29-R53 PolarHBondContact OD1-NH1 3.08Å; I51-R53 PolarHBondContact O-N 3.13Å; I51-R53 VanDerWaalsContact O-N 3.13Å; R53-R88 PolarHBondContact O-N 3.42Å
54	D	81	Confident	75.6	Confident	117 Å²	117	67.4 Å²	67.4	63%	0.626	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-8.5	-173.6	-62.5	-48.6	0	0	0	114.4
55	K	85.3	Confident	76.4	Confident	75 Å²	75	70.1 Å²	70.1	33%	0.326	37%	0.368	S	S	.	.	S	Bend	trans	-92.6	160.1	-179.4	-70.5	176.8	-171.9	163.3	0	111.3	P52 I59 S60 Y63 R86 V87	P52-K55 HydrophobicContact CB-CD 4.1Å; P52-K55 HydrophobicContact CB-CG 4.49Å; K55-I59 HydrophobicContact CD-CG2 4.25Å; K55-S60 VanDerWaalsContact CB-OG 3.27Å; K55-S60 WeakPolarHBondContact CB-OG 3.22Å; K55-Y63 HydrophobicContact CD-CE2 4.06Å; K55-Y63 PolarHBondContact NZ-OH 3.36Å; K55-R86 WeakPolarHBondContact O-CA 3.5Å; K55-V87 PolarHBondContact O-N 2.71Å
56	R	88.8	Confident	77.5	Confident	129 Å²	129	67.9 Å²	67.9	49%	0.487	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-62.6	142.8	170.2	-64.7	-177.2	-178.6	-157.9	-6.9	109.9	V58 I59 S60 D84 V85	R56-V58 VanDerWaalsContact C-N 3.25Å; R56-V58 PolarHBondContact O-N 2.94Å; R56-I59 PolarHBondContact O-N 3.13Å; R56-S60 WeakPolarHBondContact O-CB 3.24Å; R56-S60 PolarHBondContact O-N 3.28Å; R56-S60 PolarHBondContact O-OG 2.94Å; R56-D84 IonicContact CZ-OD1 3.57Å; R56-D84 VanDerWaalsContact CZ-OD1 3.32Å; R56-D84 IonicContact NH1-OD1 2.62Å; R56-D84 PolarHBondContact NH1-OD1 3.45Å; R56-D84 IonicContact NH2-OD1 2.9Å; R56-V85 WeakPolarHBondContact CA-O 3.37Å
57	V	88	Confident	79	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.018	35%	0.347	C	S	.	.	H	α-helix	trans	-56.5	-39.6	-174.4	-176	0	0	0	0	112	I59 S60 L61 L76 V85 V87 L90 I98	V57-I59 VanDerWaalsContact C-N 3.32Å; V57-I59 PolarHBondContact O-N 3.27Å; V57-S60 PolarHBondContact O-N 2.97Å; V57-L61 HydrophobicContact CG1-CD1 4.14Å; V57-L61 HydrophobicContact CG1-CG 4.23Å; V57-L61 WeakPolarHBondContact O-CG 3.44Å; V57-L61 PolarHBondContact O-N 3.43Å; V57-L76 HydrophobicContact CB-CD1 4.4Å; V57-L76 HydrophobicContact CB-CD2 4.3Å; V57-L76 HydrophobicContact CG1-CD1 4.27Å; V57-L76 HydrophobicContact CG1-CD2 3.63Å; V57-L76 HydrophobicContact CG1-CG 4.49Å; V57-V85 WeakPolarHBondContact CG2-O 3.32Å; V57-V85 PolarHBondContact N-O 2.92Å; V57-V87 HydrophobicContact CG2-CG2 4.04Å; V57-L90 HydrophobicContact CG1-CD1 4.48Å; V57-L90 HydrophobicContact CG2-CD1 3.83Å; V57-L90 HydrophobicContact CG2-CD2 3.99Å; V57-L90 HydrophobicContact CG2-CG 3.99Å; V57-I98 HydrophobicContact CG1-CD1 4.1Å
58	V	89.5	Confident	80.7	Confident	14 Å²	14	63 Å²	63	9%	0.085	34%	0.343	C	S	.	.	H	α-helix	trans	-53.4	-48.5	176.2	-179	0	0	0	0	111.8	R56 T62 A72 K73 L76 E83	R56-V58 VanDerWaalsContact C-N 3.25Å; R56-V58 PolarHBondContact O-N 2.94Å; V58-T62 WeakPolarHBondContact O-CG2 3.3Å; V58-A72 HydrophobicContact CG1-CB 4.27Å; V58-A72 WeakPolarHBondContact O-CB 3.47Å; V58-K73 HydrophobicContact CG1-CG 4.23Å; V58-L76 HydrophobicContact CB-CD1 4.24Å; V58-L76 HydrophobicContact CG2-CD1 3.43Å; V58-L76 VanDerWaalsContact CG2-CD1 3.43Å; V58-E83 HydrophobicContact CG2-CB 3.5Å; V58-E83 HydrophobicContact CG2-CG 3.6Å
59	I	90	Very high	82.4	Confident	81 Å²	81	63.8 Å²	63.8	42%	0.415	33%	0.327	S	S	.	.	H	α-helix	trans	-75.2	-40.2	-177	-60.4	173.2	0	0	0	109.5	K55 R56 V57 L61 T62 Y63	K55-I59 HydrophobicContact CD-CG2 4.25Å; R56-I59 PolarHBondContact O-N 3.13Å; V57-I59 VanDerWaalsContact C-N 3.32Å; V57-I59 PolarHBondContact O-N 3.27Å; I59-L61 VanDerWaalsContact C-N 3.3Å; I59-L61 PolarHBondContact O-N 3.28Å; I59-T62 PolarHBondContact O-N 3.3Å; I59-T62 VanDerWaalsContact O-N 3.1Å; I59-T62 PolarHBondContact O-OG1 2.6Å; I59-Y63 HydrophobicContact CG2-CE2 4.34Å; I59-Y63 WeakPolarHBondContact O-CD2 3.41Å
60	S	86.9	Confident	84.4	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.007	33%	0.332	C	S	.	.	H	α-helix	trans	-58	-41.7	178.5	-71.8	0	0	0	0	112.3	I51 P52 K55 R56 V57 T62 Y63 V87	I51-S60 VanDerWaalsContact CG2-CB 3.46Å; P52-S60 PolarHBondContact O-OG 3.39Å; P52-S60 VanDerWaalsContact O-OG 3.07Å; K55-S60 VanDerWaalsContact CB-OG 3.27Å; K55-S60 WeakPolarHBondContact CB-OG 3.22Å; R56-S60 WeakPolarHBondContact O-CB 3.24Å; R56-S60 PolarHBondContact O-N 3.28Å; R56-S60 PolarHBondContact O-OG 2.94Å; V57-S60 PolarHBondContact O-N 2.97Å; S60-T62 VanDerWaalsContact C-N 3.28Å; S60-T62 PolarHBondContact O-N 3.14Å; S60-Y63 WeakPolarHBondContact O-CB 3.48Å; S60-Y63 PolarHBondContact O-N 2.94Å; S60-V87 VanDerWaalsContact CB-CG2 3.49Å; S60-V87 VanDerWaalsContact OG-CG2 3.3Å; S60-V87 WeakPolarHBondContact OG-CG2 3.49Å
61	L	87	Confident	85.9	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-30.7	176.4	-73	174.8	0	0	0	113.1	V57 I59 Y63 I64 I67 A72 I75 L76 I98	V57-L61 HydrophobicContact CG1-CD1 4.14Å; V57-L61 HydrophobicContact CG1-CG 4.23Å; V57-L61 WeakPolarHBondContact O-CG 3.44Å; V57-L61 PolarHBondContact O-N 3.43Å; I59-L61 VanDerWaalsContact C-N 3.3Å; I59-L61 PolarHBondContact O-N 3.28Å; L61-Y63 PolarHBondContact O-N 3.36Å; L61-Y63 VanDerWaalsContact O-N 3.17Å; L61-I64 HydrophobicContact CD2-CD1 4.18Å; L61-I64 WeakPolarHBondContact O-CB 3.5Å; L61-I64 PolarHBondContact O-N 2.91Å; L61-I67 HydrophobicContact CB-CG2 4.13Å; L61-I67 WeakPolarHBondContact O-CB 3.27Å; L61-A72 HydrophobicContact CB-CB 3.98Å; L61-A72 HydrophobicContact CD1-CB 4.23Å; L61-I75 HydrophobicContact CD1-CG2 4.22Å; L61-L76 HydrophobicContact CD1-CD1 4.46Å; L61-L76 HydrophobicContact CD1-CD2 4.39Å; L61-L76 HydrophobicContact CD1-CG 4.21Å; L61-I98 HydrophobicContact CD2-CG2 4.04Å
62	T	90	Very high	87	Confident	43 Å²	43	56.8 Å²	56.8	26%	0.264	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.4	179.1	69	0	0	0	0	115.2	V58 I59 S60 I67 N69 A72	V58-T62 WeakPolarHBondContact O-CG2 3.3Å; I59-T62 PolarHBondContact O-N 3.3Å; I59-T62 VanDerWaalsContact O-N 3.1Å; I59-T62 PolarHBondContact O-OG1 2.6Å; S60-T62 VanDerWaalsContact C-N 3.28Å; S60-T62 PolarHBondContact O-N 3.14Å; T62-I67 WeakPolarHBondContact CA-O 3.3Å; T62-N69 WeakPolarHBondContact CG2-OD1 3.43Å; T62-A72 HydrophobicContact CG2-CB 4.45Å
63	Y	87.3	Confident	88.1	Confident	133 Å²	133	59.1 Å²	59.1	52%	0.522	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-23	170.5	-78.8	-92.3	0	0	0	112	P52 K55 I59 S60 L61 Y65	P52-Y63 HydrophobicContact CG-CD2 4.34Å; P52-Y63 HydrophobicContact CG-CG 4.42Å; K55-Y63 HydrophobicContact CD-CE2 4.06Å; K55-Y63 PolarHBondContact NZ-OH 3.36Å; I59-Y63 HydrophobicContact CG2-CE2 4.34Å; I59-Y63 WeakPolarHBondContact O-CD2 3.41Å; S60-Y63 WeakPolarHBondContact O-CB 3.48Å; S60-Y63 PolarHBondContact O-N 2.94Å; L61-Y63 PolarHBondContact O-N 3.36Å; L61-Y63 VanDerWaalsContact O-N 3.17Å; Y63-Y65 PolarHBondContact O-N 3.08Å
64	I	84.9	Confident	89.1	Confident	18 Å²	18	59.5 Å²	59.5	9%	0.092	31%	0.305	C	S	.	.	S	Bend	trans	-76.5	118.1	174.1	-52.8	177.8	0	0	0	108.4	V49 I51 L61 G66 I67 V107 E108	V49-I64 HydrophobicContact CG1-CD1 4.36Å; I51-I64 HydrophobicContact CD1-CD1 4.2Å; L61-I64 HydrophobicContact CD2-CD1 4.18Å; L61-I64 WeakPolarHBondContact O-CB 3.5Å; L61-I64 PolarHBondContact O-N 2.91Å; I64-G66 PolarHBondContact O-N 3.29Å; I64-I67 HydrophobicContact CB-CD1 3.96Å; I64-I67 HydrophobicContact CB-CG1 4.2Å; I64-I67 HydrophobicContact CD1-CD1 4.16Å; I64-I67 HydrophobicContact CG2-CD1 4.06Å; I64-I67 HydrophobicContact CG2-CG1 4.27Å; I64-I67 PolarHBondContact O-N 3.48Å; I64-V107 HydrophobicContact CG2-CB 3.95Å; I64-V107 HydrophobicContact CG2-CG1 3.55Å; I64-E108 WeakPolarHBondContact CA-OE1 3.46Å; I64-E108 HydrophobicContact CG2-CG 3.81Å
65	Y	84.1	Confident	89.6	Confident	96 Å²	96	54.2 Å²	54.2	38%	0.376	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	122.6	-179.5	-178.2	-96.5	0	0	0	111.6	Y63 E108 L111 R112	Y63-Y65 PolarHBondContact O-N 3.08Å; Y65-E108 VanDerWaalsContact CB-CD 3.43Å; Y65-E108 WeakPolarHBondContact CB-OE1 3.49Å; Y65-E108 WeakPolarHBondContact CB-OE2 3.34Å; Y65-E108 PolarHBondContact N-OE1 2.84Å; Y65-E108 PolarHBondContact O-N 3.12Å; Y65-L111 HydrophobicContact CD1-CB 4.34Å; Y65-L111 HydrophobicContact CD1-CD2 4.09Å; Y65-L111 HydrophobicContact CD1-CG 4.48Å; Y65-L111 HydrophobicContact CE1-CB 4.14Å; Y65-L111 HydrophobicContact CE1-CD2 3.79Å; Y65-L111 HydrophobicContact CE1-CG 3.94Å; Y65-R112 HydrophobicContact CD1-CG 3.58Å; Y65-R112 HydrophobicContact CE1-CB 4.46Å; Y65-R112 HydrophobicContact CE1-CG 3.34Å; Y65-R112 HydrophobicContact CG-CG 4.38Å
66	G	86.6	Confident	89.9	Confident	43 Å²	43	50.7 Å²	50.7	44%	0.443	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	-19.2	-175.3	0	0	0	0	0	112.9	I64 L111	I64-G66 PolarHBondContact O-N 3.29Å; G66-L111 VanDerWaalsContact CA-CD2 3.47Å
67	I	90	Very high	90.1	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.051	27%	0.268	C	S	.	.			trans	-95	122.4	172.7	-51.4	-173.9	0	0	0	109.1	L61 T62 I64 T71 A72 I75 V102 V107	L61-I67 HydrophobicContact CB-CG2 4.13Å; L61-I67 WeakPolarHBondContact O-CB 3.27Å; T62-I67 WeakPolarHBondContact CA-O 3.3Å; I64-I67 HydrophobicContact CB-CD1 3.96Å; I64-I67 HydrophobicContact CB-CG1 4.2Å; I64-I67 HydrophobicContact CD1-CD1 4.16Å; I64-I67 HydrophobicContact CG2-CD1 4.06Å; I64-I67 HydrophobicContact CG2-CG1 4.27Å; I64-I67 PolarHBondContact O-N 3.48Å; I67-T71 WeakPolarHBondContact CA-OG1 3.39Å; I67-T71 WeakPolarHBondContact CG2-OG1 3.36Å; I67-A72 HydrophobicContact CG2-CB 3.89Å; I67-I75 HydrophobicContact CD1-CD1 3.95Å; I67-I75 HydrophobicContact CG2-CD1 4.2Å; I67-V102 HydrophobicContact CD1-CG1 4.33Å; I67-V102 HydrophobicContact CD1-CG2 4.12Å; I67-V107 HydrophobicContact CD1-CG1 3.88Å; I67-V107 HydrophobicContact CG1-CG1 3.53Å
68	G	91.5	Very high	90.4	Very high	30 Å²	30	53.2 Å²	53.2	31%	0.309	30%	0.295	S	S	.	.			trans	-110.9	-178.2	171	0	0	0	0	0	111.2	T70 T71 A72	G68-T70 VanDerWaalsContact C-N 3.26Å; G68-T70 PolarHBondContact O-N 2.89Å; G68-T71 PolarHBondContact N-OG1 3.22Å; G68-T71 PolarHBondContact O-N 3.07Å; G68-T71 PolarHBondContact O-OG1 3.02Å; G68-A72 VanDerWaalsContact O-CB 3.27Å; G68-A72 WeakPolarHBondContact O-CB 3.47Å; G68-A72 PolarHBondContact O-N 3.37Å
69	N	92.7	Very high	90.5	Very high	102 Å²	102	53.6 Å²	53.6	55%	0.545	30%	0.3	S	S	.	.	H	α-helix	trans	-55.7	-40	-179.7	-72.9	-16	0	0	0	113.1	T62 K73	T62-N69 WeakPolarHBondContact CG2-OD1 3.43Å; N69-K73 VanDerWaalsContact O-CG 3.3Å; N69-K73 WeakPolarHBondContact O-CG 3.24Å; N69-K73 PolarHBondContact O-N 3.47Å
70	T	94.6	Very high	90.5	Very high	103 Å²	103	53 Å²	53	63%	0.632	31%	0.314	S	S	*	.	H	α-helix	trans	-70.8	-45	-178	50.1	0	0	0	0	112	G68 K73 Q74	G68-T70 VanDerWaalsContact C-N 3.26Å; G68-T70 PolarHBondContact O-N 2.89Å; T70-K73 PolarHBondContact O-N 2.6Å; T70-Q74 WeakPolarHBondContact O-CG 3.43Å; T70-Q74 PolarHBondContact O-N 2.94Å; T70-Q74 VanDerWaalsContact O-N 3.12Å
71	T	92.9	Very high	90.5	Very high	36 Å²	36	53.4 Å²	53.4	22%	0.221	32%	0.316	C	S	.	.	H	α-helix	trans	-71.6	-35.5	179.3	52.7	0	0	0	0	111.6	I67 G68 K73 Q74 I75	I67-T71 WeakPolarHBondContact CA-OG1 3.39Å; I67-T71 WeakPolarHBondContact CG2-OG1 3.36Å; G68-T71 PolarHBondContact N-OG1 3.22Å; G68-T71 PolarHBondContact O-N 3.07Å; G68-T71 PolarHBondContact O-OG1 3.02Å; T71-K73 PolarHBondContact O-N 3.26Å; T71-Q74 WeakPolarHBondContact O-CB 3.49Å; T71-Q74 PolarHBondContact O-N 3.24Å; T71-I75 WeakPolarHBondContact O-CD1 3.43Å; T71-I75 VanDerWaalsContact O-CG1 3.26Å; T71-I75 WeakPolarHBondContact O-CG1 3.49Å; T71-I75 PolarHBondContact O-N 3.39Å
72	A	91.6	Very high	90.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-44.7	172.5	0	0	0	0	0	112.1	V58 L61 T62 I67 G68 Q74 I75 L76	V58-A72 HydrophobicContact CG1-CB 4.27Å; V58-A72 WeakPolarHBondContact O-CB 3.47Å; L61-A72 HydrophobicContact CB-CB 3.98Å; L61-A72 HydrophobicContact CD1-CB 4.23Å; T62-A72 HydrophobicContact CG2-CB 4.45Å; I67-A72 HydrophobicContact CG2-CB 3.89Å; G68-A72 VanDerWaalsContact O-CB 3.27Å; G68-A72 WeakPolarHBondContact O-CB 3.47Å; G68-A72 PolarHBondContact O-N 3.37Å; A72-Q74 VanDerWaalsContact C-N 3.34Å; A72-Q74 PolarHBondContact O-N 2.82Å; A72-I75 PolarHBondContact O-N 2.78Å; A72-L76 WeakPolarHBondContact O-CG 3.37Å; A72-L76 PolarHBondContact O-N 3.02Å
73	K	94	Very high	90.5	Very high	92 Å²	92	57.9 Å²	57.9	40%	0.4	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-40.4	174.9	-71.8	174.6	173.5	-86.6	0	112.3	V58 N69 T70 T71 L76 A77 E83	V58-K73 HydrophobicContact CG1-CG 4.23Å; N69-K73 VanDerWaalsContact O-CG 3.3Å; N69-K73 WeakPolarHBondContact O-CG 3.24Å; N69-K73 PolarHBondContact O-N 3.47Å; T70-K73 PolarHBondContact O-N 2.6Å; T71-K73 PolarHBondContact O-N 3.26Å; K73-L76 PolarHBondContact O-N 3.39Å; K73-A77 WeakPolarHBondContact O-CB 3.48Å; K73-A77 PolarHBondContact O-N 3.41Å; K73-E83 WeakPolarHBondContact CG-OE1 3.49Å; K73-E83 IonicContact NZ-OE1 2.75Å; K73-E83 PolarHBondContact NZ-OE1 3.19Å; K73-E83 IonicContact NZ-OE2 3.25Å; K73-E83 PolarHBondContact NZ-OE2 2.92Å
74	Q	93.5	Very high	90.6	Very high	118 Å²	118	56.3 Å²	56.3	55%	0.551	34%	0.342	S	S	*	.	H	α-helix	trans	-63.6	-44.4	176.5	-71.9	171.1	-18.9	0	0	112	T70 T71 A72 L76 A77 N78	T70-Q74 WeakPolarHBondContact O-CG 3.43Å; T70-Q74 PolarHBondContact O-N 2.94Å; T70-Q74 VanDerWaalsContact O-N 3.12Å; T71-Q74 WeakPolarHBondContact O-CB 3.49Å; T71-Q74 PolarHBondContact O-N 3.24Å; A72-Q74 VanDerWaalsContact C-N 3.34Å; A72-Q74 PolarHBondContact O-N 2.82Å; Q74-L76 VanDerWaalsContact C-N 3.32Å; Q74-L76 PolarHBondContact O-N 3.37Å; Q74-A77 PolarHBondContact O-N 2.93Å; Q74-N78 WeakPolarHBondContact O-CB 3.28Å; Q74-N78 PolarHBondContact O-N 2.99Å; Q74-N78 PolarHBondContact O-OD1 2.88Å
75	I	93.2	Very high	90.7	Very high	6 Å²	6	57.3 Å²	57.3	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-57.9	-46.4	175.7	-70.8	161.8	0	0	0	110.5	L61 I67 T71 A72 N78 A79 I98 E101 V102 L105	L61-I75 HydrophobicContact CD1-CG2 4.22Å; I67-I75 HydrophobicContact CD1-CD1 3.95Å; I67-I75 HydrophobicContact CG2-CD1 4.2Å; T71-I75 WeakPolarHBondContact O-CD1 3.43Å; T71-I75 VanDerWaalsContact O-CG1 3.26Å; T71-I75 WeakPolarHBondContact O-CG1 3.49Å; T71-I75 PolarHBondContact O-N 3.39Å; A72-I75 PolarHBondContact O-N 2.78Å; I75-N78 PolarHBondContact O-N 3.44Å; I75-A79 VanDerWaalsContact O-CB 3.28Å; I75-A79 WeakPolarHBondContact O-CB 3.44Å; I75-A79 PolarHBondContact O-N 3.5Å; I75-I98 HydrophobicContact CG2-CG2 4.23Å; I75-E101 HydrophobicContact CG2-CB 3.92Å; I75-V102 HydrophobicContact CD1-CG2 4.1Å; I75-V102 HydrophobicContact CG2-CG2 4.33Å; I75-L105 HydrophobicContact CD1-CD1 3.89Å; I75-L105 HydrophobicContact CG1-CD1 4.2Å
76	L	91.7	Very high	90.8	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-69.2	-39.1	-179	-69.7	169.6	0	0	0	113	V57 V58 L61 A72 K73 Q74 N78 A79 G80 V81 E83 I98	V57-L76 HydrophobicContact CB-CD1 4.4Å; V57-L76 HydrophobicContact CB-CD2 4.3Å; V57-L76 HydrophobicContact CG1-CD1 4.27Å; V57-L76 HydrophobicContact CG1-CD2 3.63Å; V57-L76 HydrophobicContact CG1-CG 4.49Å; V58-L76 HydrophobicContact CB-CD1 4.24Å; V58-L76 HydrophobicContact CG2-CD1 3.43Å; V58-L76 VanDerWaalsContact CG2-CD1 3.43Å; L61-L76 HydrophobicContact CD1-CD1 4.46Å; L61-L76 HydrophobicContact CD1-CD2 4.39Å; L61-L76 HydrophobicContact CD1-CG 4.21Å; A72-L76 WeakPolarHBondContact O-CG 3.37Å; A72-L76 PolarHBondContact O-N 3.02Å; K73-L76 PolarHBondContact O-N 3.39Å; Q74-L76 VanDerWaalsContact C-N 3.32Å; Q74-L76 PolarHBondContact O-N 3.37Å; L76-N78 VanDerWaalsContact C-N 3.33Å; L76-N78 PolarHBondContact O-N 3.39Å; L76-A79 PolarHBondContact O-N 2.96Å; L76-G80 PolarHBondContact O-N 3.37Å; L76-V81 HydrophobicContact CD2-CB 3.86Å; L76-V81 HydrophobicContact CD2-CG1 4.06Å; L76-V81 PolarHBondContact O-N 2.73Å; L76-E83 HydrophobicContact CD1-CG 4.38Å; L76-I98 HydrophobicContact CD2-CD1 4.01Å; L76-I98 HydrophobicContact CD2-CG1 4.28Å
77	A	93.2	Very high	90.6	Very high	77 Å²	77	57 Å²	57	64%	0.636	34%	0.336	S	S	*	.	H	α-helix	trans	-61.4	-42.4	173.8	0	0	0	0	0	111.6	K73 Q74 G80	K73-A77 WeakPolarHBondContact O-CB 3.48Å; K73-A77 PolarHBondContact O-N 3.41Å; Q74-A77 PolarHBondContact O-N 2.93Å; A77-G80 PolarHBondContact O-N 2.9Å
78	N	92.8	Very high	90.2	Very high	108 Å²	108	62.7 Å²	62.7	58%	0.578	36%	0.357	S	S	*	.	H	α-helix	trans	-69.7	-39.3	177.3	-67.9	-10.7	0	0	0	112.4	Q74 I75 L76 G80 E101	Q74-N78 WeakPolarHBondContact O-CB 3.28Å; Q74-N78 PolarHBondContact O-N 2.99Å; Q74-N78 PolarHBondContact O-OD1 2.88Å; I75-N78 PolarHBondContact O-N 3.44Å; L76-N78 VanDerWaalsContact C-N 3.33Å; L76-N78 PolarHBondContact O-N 3.39Å; N78-G80 PolarHBondContact O-N 2.62Å; N78-E101 HydrophobicContact CB-CG 4.06Å
79	A	91.1	Very high	89.9	Confident	23 Å²	23	65.6 Å²	65.6	19%	0.19	37%	0.366	C	S	.	.	H	α-helix	trans	-74.6	-10.4	177.6	0	0	0	0	0	113.3	I75 L76 V81 A97 I98 E101	I75-A79 VanDerWaalsContact O-CB 3.28Å; I75-A79 WeakPolarHBondContact O-CB 3.44Å; I75-A79 PolarHBondContact O-N 3.5Å; L76-A79 PolarHBondContact O-N 2.96Å; A79-V81 VanDerWaalsContact C-N 3.31Å; A79-V81 HydrophobicContact CB-CG2 4.06Å; A79-V81 PolarHBondContact O-N 3.01Å; A79-A97 HydrophobicContact CB-CB 4.13Å; A79-I98 HydrophobicContact CB-CG1 4.11Å; A79-E101 HydrophobicContact CB-CG 4.45Å
80	G	90.1	Very high	89.4	Confident	69 Å²	69	62.3 Å²	62.3	71%	0.711	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	23.7	-177	0	0	0	0	0	114	L76 A77 N78	L76-G80 PolarHBondContact O-N 3.37Å; A77-G80 PolarHBondContact O-N 2.9Å; N78-G80 PolarHBondContact O-N 2.62Å
81	V	88.4	Confident	89	Confident	9 Å²	9	60.6 Å²	60.6	6%	0.055	34%	0.337	C	S	.	.			trans	-102.2	137.5	-178	-176.3	0	0	0	0	110.1	L76 A79 L90 Q94 I98	L76-V81 HydrophobicContact CD2-CB 3.86Å; L76-V81 HydrophobicContact CD2-CG1 4.06Å; L76-V81 PolarHBondContact O-N 2.73Å; A79-V81 VanDerWaalsContact C-N 3.31Å; A79-V81 HydrophobicContact CB-CG2 4.06Å; A79-V81 PolarHBondContact O-N 3.01Å; V81-L90 HydrophobicContact CG1-CD2 3.86Å; V81-Q94 HydrophobicContact CG2-CB 3.85Å; V81-Q94 HydrophobicContact CG2-CG 3.82Å; V81-I98 HydrophobicContact CG2-CD1 4.28Å; V81-I98 HydrophobicContact CG2-CG1 4.37Å
82	S	89.3	Confident	88.5	Confident	69 Å²	69	65.2 Å²	65.2	48%	0.483	36%	0.361	S	S	.	.			trans	-71.4	140.8	177.5	174.4	0	0	0	0	112.4	D84	S82-D84 VanDerWaalsContact C-N 3.29Å; S82-D84 PolarHBondContact O-N 2.71Å
83	E	87.9	Confident	88.3	Confident	72 Å²	72	72.9 Å²	72.9	34%	0.336	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.6	-179.1	-70.2	-168.9	-160.8	0	0	114.2	V58 K73 L76	V58-E83 HydrophobicContact CG2-CB 3.5Å; V58-E83 HydrophobicContact CG2-CG 3.6Å; K73-E83 WeakPolarHBondContact CG-OE1 3.49Å; K73-E83 IonicContact NZ-OE1 2.75Å; K73-E83 PolarHBondContact NZ-OE1 3.19Å; K73-E83 IonicContact NZ-OE2 3.25Å; K73-E83 PolarHBondContact NZ-OE2 2.92Å; L76-E83 HydrophobicContact CD1-CG 4.38Å
84	D	87.8	Confident	87.9	Confident	101 Å²	101	71.2 Å²	71.2	54%	0.54	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-11.4	-174	-72.5	-50	0	0	0	113.6	R56 S82	R56-D84 IonicContact CZ-OD1 3.57Å; R56-D84 VanDerWaalsContact CZ-OD1 3.32Å; R56-D84 IonicContact NH1-OD1 2.62Å; R56-D84 PolarHBondContact NH1-OD1 3.45Å; R56-D84 IonicContact NH2-OD1 2.9Å; S82-D84 VanDerWaalsContact C-N 3.29Å; S82-D84 PolarHBondContact O-N 2.71Å
85	V	87.3	Confident	87.5	Confident	38 Å²	38	67.4 Å²	67.4	23%	0.23	38%	0.375	C	S	.	.			trans	-65.8	145.2	178.1	-175.9	0	0	0	0	109.4	R56 V57 D89 L90	R56-V85 WeakPolarHBondContact CA-O 3.37Å; V57-V85 WeakPolarHBondContact CG2-O 3.32Å; V57-V85 PolarHBondContact N-O 2.92Å; V85-D89 HydrophobicContact CG1-CB 4.09Å; V85-L90 HydrophobicContact CG1-CD2 4.31Å
86	R	87.5	Confident	87.2	Confident	108 Å²	108	71.1 Å²	71.1	41%	0.408	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-92	152.1	171.4	-66.6	-174.2	179.7	-164.8	0.7	109.8	K55 R88 D89	K55-R86 WeakPolarHBondContact O-CA 3.5Å; R86-R88 HydrophobicContact CB-CG 4.1Å; R86-R88 PolarHBondContact O-N 3.17Å; R86-R88 VanDerWaalsContact O-N 3.13Å; R86-D89 PolarHBondContact O-N 3.27Å
87	V	81.8	Confident	87.1	Confident	25 Å²	25	72.8 Å²	72.8	15%	0.152	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-57.6	-32.7	-177.8	173	0	0	0	0	112.6	I51 K55 V57 S60 D89 L90	I51-V87 HydrophobicContact CG2-CG1 4.35Å; I51-V87 HydrophobicContact CG2-CG2 4.06Å; K55-V87 PolarHBondContact O-N 2.71Å; V57-V87 HydrophobicContact CG2-CG2 4.04Å; S60-V87 VanDerWaalsContact CB-CG2 3.49Å; S60-V87 VanDerWaalsContact OG-CG2 3.3Å; S60-V87 WeakPolarHBondContact OG-CG2 3.49Å; V87-D89 VanDerWaalsContact C-N 3.26Å; V87-D89 PolarHBondContact O-N 3.35Å; V87-L90 HydrophobicContact CG1-CD1 4.41Å; V87-L90 PolarHBondContact O-N 3.01Å
88	R	80.3	Confident	86.9	Confident	130 Å²	130	69.7 Å²	69.7	49%	0.491	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-64.5	-26.1	176.1	73.4	-172.7	-175.1	172.3	5.5	114.7	R53 R86	R53-R88 PolarHBondContact O-N 3.42Å; R86-R88 HydrophobicContact CB-CG 4.1Å; R86-R88 PolarHBondContact O-N 3.17Å; R86-R88 VanDerWaalsContact O-N 3.13Å
89	D	85.7	Confident	86.7	Confident	91 Å²	91	70 Å²	70	49%	0.487	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-99.7	7.4	-173.2	-58.4	-52.2	0	0	0	111.1	V85 R86 V87	V85-D89 HydrophobicContact CG1-CB 4.09Å; R86-D89 PolarHBondContact O-N 3.27Å; V87-D89 VanDerWaalsContact C-N 3.26Å; V87-D89 PolarHBondContact O-N 3.35Å
90	L	81.7	Confident	86.6	Confident	32 Å²	32	71.4 Å²	71.4	17%	0.168	39%	0.386	C	S	.	.			trans	-73.1	137.5	175.9	-75.2	172.9	0	0	0	111	V57 V81 V85 V87 Q94 I98	V57-L90 HydrophobicContact CG1-CD1 4.48Å; V57-L90 HydrophobicContact CG2-CD1 3.83Å; V57-L90 HydrophobicContact CG2-CD2 3.99Å; V57-L90 HydrophobicContact CG2-CG 3.99Å; V81-L90 HydrophobicContact CG1-CD2 3.86Å; V85-L90 HydrophobicContact CG1-CD2 4.31Å; V87-L90 HydrophobicContact CG1-CD1 4.41Å; V87-L90 PolarHBondContact O-N 3.01Å; L90-Q94 HydrophobicContact CD2-CB 4.08Å; L90-I98 HydrophobicContact CD1-CD1 4.23Å; L90-I98 HydrophobicContact CD2-CD1 4.18Å
91	T	87.7	Confident	86.6	Confident	67 Å²	67	69.7 Å²	69.7	41%	0.411	36%	0.359	S	S	.	.			trans	-78.3	160.7	168.9	71	0	0	0	0	110.6	E93 Q94 T95	T91-E93 VanDerWaalsContact C-N 3.3Å; T91-E93 PolarHBondContact O-N 3.1Å; T91-Q94 PolarHBondContact O-N 2.93Å; T91-Q94 VanDerWaalsContact OG1-CG 3.24Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.42Å; T91-Q94 PolarHBondContact OG1-N 3.23Å; T91-T95 PolarHBondContact O-N 2.99Å; T91-T95 PolarHBondContact O-OG1 2.91Å
92	N	82.5	Confident	86.6	Confident	133 Å²	133	70.1 Å²	70.1	71%	0.711	36%	0.362	S	S	*	.	H	α-helix	trans	-60.4	-42.3	177.3	-66.7	-24	0	0	0	111.3	Q94 T95 D96	N92-Q94 VanDerWaalsContact C-N 3.35Å; N92-Q94 PolarHBondContact O-N 2.65Å; N92-T95 WeakPolarHBondContact O-CB 3.37Å; N92-T95 PolarHBondContact O-N 2.92Å; N92-T95 VanDerWaalsContact O-N 3.11Å; N92-D96 PolarHBondContact O-N 2.96Å
93	E	86	Confident	86.6	Confident	162 Å²	162	73.1 Å²	73.1	76%	0.757	37%	0.373	S	S	*	.	H	α-helix	trans	-58.6	-44.2	176.6	-63	178.2	176.4	0	0	112.3	T91 T95 D96 A97	T91-E93 VanDerWaalsContact C-N 3.3Å; T91-E93 PolarHBondContact O-N 3.1Å; E93-T95 VanDerWaalsContact C-N 3.31Å; E93-T95 PolarHBondContact O-N 2.99Å; E93-D96 PolarHBondContact O-N 3.23Å; E93-A97 WeakPolarHBondContact O-CB 3.39Å; E93-A97 PolarHBondContact O-N 3.38Å
94	Q	86.4	Confident	86.6	Confident	57 Å²	57	76.5 Å²	76.5	27%	0.266	39%	0.386	S	S	.	.	H	α-helix	trans	-65.5	-38	176.7	-70.8	175.7	-20.1	0	0	111.6	V81 L90 T91 N92 D96 A97 I98	V81-Q94 HydrophobicContact CG2-CB 3.85Å; V81-Q94 HydrophobicContact CG2-CG 3.82Å; L90-Q94 HydrophobicContact CD2-CB 4.08Å; T91-Q94 PolarHBondContact O-N 2.93Å; T91-Q94 VanDerWaalsContact OG1-CG 3.24Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.42Å; T91-Q94 PolarHBondContact OG1-N 3.23Å; N92-Q94 VanDerWaalsContact C-N 3.35Å; N92-Q94 PolarHBondContact O-N 2.65Å; Q94-D96 VanDerWaalsContact C-N 3.35Å; Q94-A97 PolarHBondContact O-N 3.31Å; Q94-I98 WeakPolarHBondContact O-CB 3.18Å; Q94-I98 WeakPolarHBondContact O-CD1 3.49Å; Q94-I98 WeakPolarHBondContact O-CG1 3.47Å; Q94-I98 PolarHBondContact O-N 2.68Å
95	T	85.1	Confident	86.6	Confident	38 Å²	38	75.4 Å²	75.4	23%	0.233	38%	0.38	C	S	.	.	H	α-helix	trans	-63.5	-43.4	177.5	-57.2	0	0	0	0	110.7	T91 N92 E93 I98 R99	T91-T95 PolarHBondContact O-N 2.99Å; T91-T95 PolarHBondContact O-OG1 2.91Å; N92-T95 WeakPolarHBondContact O-CB 3.37Å; N92-T95 PolarHBondContact O-N 2.92Å; N92-T95 VanDerWaalsContact O-N 3.11Å; E93-T95 VanDerWaalsContact C-N 3.31Å; E93-T95 PolarHBondContact O-N 2.99Å; T95-I98 PolarHBondContact O-N 3.07Å; T95-R99 VanDerWaalsContact O-CG 3.3Å; T95-R99 WeakPolarHBondContact O-CG 3.27Å; T95-R99 PolarHBondContact O-N 3.44Å
96	D	86.8	Confident	86.4	Confident	84 Å²	84	79.6 Å²	79.6	45%	0.449	40%	0.395	S	S	.	.	H	α-helix	trans	-71	-36.3	178.4	-66.3	-29.2	0	0	0	112.1	N92 E93 Q94 R99 A100	N92-D96 PolarHBondContact O-N 2.96Å; E93-D96 PolarHBondContact O-N 3.23Å; Q94-D96 VanDerWaalsContact C-N 3.35Å; D96-R99 PolarHBondContact O-N 2.88Å; D96-R99 IonicContact OD1-NH1 2.75Å; D96-R99 PolarHBondContact OD1-NH1 3.38Å; D96-A100 WeakPolarHBondContact O-CB 3.18Å; D96-A100 PolarHBondContact O-N 3.49Å
97	A	89.7	Confident	86.3	Confident	35 Å²	35	75.6 Å²	75.6	29%	0.289	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-44.6	171.4	0	0	0	0	0	112.1	A79 E93 Q94 R99 A100 E101	A79-A97 HydrophobicContact CB-CB 4.13Å; E93-A97 WeakPolarHBondContact O-CB 3.39Å; E93-A97 PolarHBondContact O-N 3.38Å; Q94-A97 PolarHBondContact O-N 3.31Å; A97-R99 VanDerWaalsContact C-N 3.34Å; A97-R99 PolarHBondContact O-N 3.19Å; A97-A100 PolarHBondContact O-N 3.05Å; A97-E101 PolarHBondContact O-N 3.25Å; A97-E101 VanDerWaalsContact O-N 3.14Å
98	I	88.8	Confident	86.4	Confident	13 Å²	13	77.7 Å²	77.7	7%	0.067	39%	0.39	C	S	.	.	H	α-helix	trans	-62.5	-42.3	176	-69.4	164.7	0	0	0	110.5	V57 L61 I75 L76 A79 V81 L90 Q94 T95 E101 V102	V57-I98 HydrophobicContact CG1-CD1 4.1Å; L61-I98 HydrophobicContact CD2-CG2 4.04Å; I75-I98 HydrophobicContact CG2-CG2 4.23Å; L76-I98 HydrophobicContact CD2-CD1 4.01Å; L76-I98 HydrophobicContact CD2-CG1 4.28Å; A79-I98 HydrophobicContact CB-CG1 4.11Å; V81-I98 HydrophobicContact CG2-CD1 4.28Å; V81-I98 HydrophobicContact CG2-CG1 4.37Å; L90-I98 HydrophobicContact CD1-CD1 4.23Å; L90-I98 HydrophobicContact CD2-CD1 4.18Å; Q94-I98 WeakPolarHBondContact O-CB 3.18Å; Q94-I98 WeakPolarHBondContact O-CD1 3.49Å; Q94-I98 WeakPolarHBondContact O-CG1 3.47Å; Q94-I98 PolarHBondContact O-N 2.68Å; T95-I98 PolarHBondContact O-N 3.07Å; I98-E101 PolarHBondContact O-N 3.23Å; I98-V102 HydrophobicContact CG2-CG2 4.21Å; I98-V102 WeakPolarHBondContact O-CB 3.43Å; I98-V102 VanDerWaalsContact O-CG2 3.24Å; I98-V102 WeakPolarHBondContact O-CG2 3.31Å; I98-V102 PolarHBondContact O-N 2.91Å
99	R	88.2	Confident	86.5	Confident	115 Å²	115	73.2 Å²	73.2	43%	0.434	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-47.4	176.6	-75.3	169.1	173.5	167.5	-4.7	111.7	T95 D96 A97 E101 V102 D103	T95-R99 VanDerWaalsContact O-CG 3.3Å; T95-R99 WeakPolarHBondContact O-CG 3.27Å; T95-R99 PolarHBondContact O-N 3.44Å; D96-R99 PolarHBondContact O-N 2.88Å; D96-R99 IonicContact OD1-NH1 2.75Å; D96-R99 PolarHBondContact OD1-NH1 3.38Å; A97-R99 VanDerWaalsContact C-N 3.34Å; A97-R99 PolarHBondContact O-N 3.19Å; R99-E101 VanDerWaalsContact C-N 3.26Å; R99-E101 PolarHBondContact O-N 2.87Å; R99-V102 PolarHBondContact O-N 3.43Å; R99-V102 VanDerWaalsContact O-N 3.08Å; R99-D103 PolarHBondContact O-N 3.47Å
100	A	89.6	Confident	86.6	Confident	51 Å²	51	72.7 Å²	72.7	42%	0.421	38%	0.382	S	S	.	.	H	α-helix	trans	-60	-35	178.6	0	0	0	0	0	112.8	D96 A97	D96-A100 WeakPolarHBondContact O-CB 3.18Å; D96-A100 PolarHBondContact O-N 3.49Å; A97-A100 PolarHBondContact O-N 3.05Å
101	E	90.7	Very high	86.8	Confident	34 Å²	34	73.5 Å²	73.5	16%	0.159	39%	0.387	C	S	.	.	H	α-helix	trans	-75.2	-35.7	174.1	-70.1	-55.6	141.9	0	0	112.9	I75 N78 A79 A97 I98 R99 K104	I75-E101 HydrophobicContact CG2-CB 3.92Å; N78-E101 HydrophobicContact CB-CG 4.06Å; A79-E101 HydrophobicContact CB-CG 4.45Å; A97-E101 PolarHBondContact O-N 3.25Å; A97-E101 VanDerWaalsContact O-N 3.14Å; I98-E101 PolarHBondContact O-N 3.23Å; R99-E101 VanDerWaalsContact C-N 3.26Å; R99-E101 PolarHBondContact O-N 2.87Å; E101-K104 IonicContact OE1-NZ 2.6Å; E101-K104 PolarHBondContact OE1-NZ 3.48Å; E101-K104 IonicContact OE2-NZ 3.37Å; E101-K104 PolarHBondContact OE2-NZ 2.89Å
102	V	88.2	Confident	86.9	Confident	17 Å²	17	76 Å²	76	10%	0.103	39%	0.389	C	S	.	.	H	α-helix	trans	-68.1	-39	177.6	170.5	0	0	0	0	111.4	I67 I75 I98 R99 K104 L105 V107	I67-V102 HydrophobicContact CD1-CG1 4.33Å; I67-V102 HydrophobicContact CD1-CG2 4.12Å; I75-V102 HydrophobicContact CD1-CG2 4.1Å; I75-V102 HydrophobicContact CG2-CG2 4.33Å; I98-V102 HydrophobicContact CG2-CG2 4.21Å; I98-V102 WeakPolarHBondContact O-CB 3.43Å; I98-V102 VanDerWaalsContact O-CG2 3.24Å; I98-V102 WeakPolarHBondContact O-CG2 3.31Å; I98-V102 PolarHBondContact O-N 2.91Å; R99-V102 PolarHBondContact O-N 3.43Å; R99-V102 VanDerWaalsContact O-N 3.08Å; V102-K104 PolarHBondContact O-N 3.44Å; V102-L105 WeakPolarHBondContact O-CB 3.2Å; V102-L105 PolarHBondContact O-N 3.21Å; V102-V107 HydrophobicContact CG1-CG2 3.75Å
103	D	88.1	Confident	87.3	Confident	133 Å²	133	77.2 Å²	77.2	71%	0.711	38%	0.383	S	S	*	.	H	α-helix	trans	-64.2	-24.3	-179.2	-73.2	-22.2	0	0	0	113.5	R99 L105	R99-D103 PolarHBondContact O-N 3.47Å; D103-L105 PolarHBondContact O-N 3.49Å
104	K	89.4	Confident	87.6	Confident	143 Å²	143	73.1 Å²	73.1	62%	0.622	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.7	172.9	-62.7	173.2	-166.1	171.3	0	112.2	E101 V102	E101-K104 IonicContact OE1-NZ 2.6Å; E101-K104 PolarHBondContact OE1-NZ 3.48Å; E101-K104 IonicContact OE2-NZ 3.37Å; E101-K104 PolarHBondContact OE2-NZ 2.89Å; V102-K104 PolarHBondContact O-N 3.44Å
105	L	86.3	Confident	87.8	Confident	78 Å²	78	72.8 Å²	72.8	41%	0.408	37%	0.366	S	S	.	.	S	Bend	trans	-98.4	147.4	-178.1	-59.8	176.4	0	0	0	110.5	I75 V102 D103 V107	I75-L105 HydrophobicContact CD1-CD1 3.89Å; I75-L105 HydrophobicContact CG1-CD1 4.2Å; V102-L105 WeakPolarHBondContact O-CB 3.2Å; V102-L105 PolarHBondContact O-N 3.21Å; D103-L105 PolarHBondContact O-N 3.49Å; L105-V107 WeakPolarHBondContact O-CG2 3.48Å; L105-V107 PolarHBondContact O-N 3.38Å
106	K	84.2	Confident	88.1	Confident	125 Å²	125	75.4 Å²	75.4	54%	0.543	38%	0.378	S	S	.	.			trans	-79	107.5	170.9	-66.8	176.6	175.3	177.9	0	109.3	D110 E114	K106-D110 HydrophobicContact CB-CB 4.28Å; K106-E114 WeakPolarHBondContact CD-OE2 3.47Å; K106-E114 IonicContact NZ-OE2 3.52Å; K106-E114 PolarHBondContact NZ-OE2 3.21Å
107	V	86	Confident	88.5	Confident	25 Å²	25	76.7 Å²	76.7	15%	0.152	39%	0.385	C	S	.	.			trans	-116.2	158.8	-178.5	-103.1	0	0	0	0	112.4	I64 I67 V102 L105 G109 D110	I64-V107 HydrophobicContact CG2-CB 3.95Å; I64-V107 HydrophobicContact CG2-CG1 3.55Å; I67-V107 HydrophobicContact CD1-CG1 3.88Å; I67-V107 HydrophobicContact CG1-CG1 3.53Å; V102-V107 HydrophobicContact CG1-CG2 3.75Å; L105-V107 WeakPolarHBondContact O-CG2 3.48Å; L105-V107 PolarHBondContact O-N 3.38Å; V107-G109 PolarHBondContact O-N 2.88Å; V107-D110 PolarHBondContact O-N 3.16Å
108	E	83.4	Confident	88.6	Confident	68 Å²	68	77.8 Å²	77.8	32%	0.318	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	-105.3	174	-69.6	-66.4	169.1	0	0	114.4	I64 Y65 D110 R112	I64-E108 WeakPolarHBondContact CA-OE1 3.46Å; I64-E108 HydrophobicContact CG2-CG 3.81Å; Y65-E108 VanDerWaalsContact CB-CD 3.43Å; Y65-E108 WeakPolarHBondContact CB-OE1 3.49Å; Y65-E108 WeakPolarHBondContact CB-OE2 3.34Å; Y65-E108 PolarHBondContact N-OE1 2.84Å; Y65-E108 PolarHBondContact O-N 3.12Å; E108-D110 PolarHBondContact O-N 2.91Å; E108-R112 WeakPolarHBondContact O-CB 3.3Å; E108-R112 WeakPolarHBondContact O-CG 3.26Å; E108-R112 PolarHBondContact O-N 2.75Å; E108-R112 VanDerWaalsContact O-N 3.07Å; E108-R112 IonicContact OE2-CZ 3.32Å; E108-R112 IonicContact OE2-NE 2.71Å; E108-R112 IonicContact OE2-NH2 3.74Å; E108-R112 PolarHBondContact OE2-NH2 3.23Å
109	G	82.4	Confident	88.7	Confident	37 Å²	37	79.7 Å²	79.7	38%	0.381	40%	0.396	S	S	.	.	H	α-helix	trans	-63.3	-40.7	-172.4	0	0	0	0	0	112.5	V107 R112 R113	V107-G109 PolarHBondContact O-N 2.88Å; G109-R112 PolarHBondContact O-N 3.07Å; G109-R113 VanDerWaalsContact O-CB 3.31Å; G109-R113 WeakPolarHBondContact O-CB 3.31Å; G109-R113 WeakPolarHBondContact O-CG 3.25Å; G109-R113 PolarHBondContact O-N 2.87Å
110	D	86.7	Confident	89	Confident	80 Å²	80	78.7 Å²	78.7	43%	0.428	39%	0.394	S	S	.	.	H	α-helix	trans	-68.3	-47.8	-176.1	-69	-36.1	0	0	0	111.9	K106 V107 E108 R112 R113 E114	K106-D110 HydrophobicContact CB-CB 4.28Å; V107-D110 PolarHBondContact O-N 3.16Å; E108-D110 PolarHBondContact O-N 2.91Å; D110-R112 VanDerWaalsContact C-N 3.33Å; D110-R112 PolarHBondContact O-N 2.9Å; D110-R113 PolarHBondContact O-N 3.3Å; D110-R113 IonicContact OD1-CZ 2.69Å; D110-R113 IonicContact OD1-NE 3.61Å; D110-R113 IonicContact OD1-NH2 3.06Å; D110-R113 PolarHBondContact OD1-NH2 3.45Å; D110-E114 WeakPolarHBondContact O-CB 3.45Å; D110-E114 PolarHBondContact O-N 3.31Å
111	L	87.6	Confident	89.3	Confident	49 Å²	49	82.9 Å²	82.9	26%	0.257	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-39.8	177.9	-172.2	62.9	0	0	0	111.5	Y65 G66 T115	Y65-L111 HydrophobicContact CD1-CB 4.34Å; Y65-L111 HydrophobicContact CD1-CD2 4.09Å; Y65-L111 HydrophobicContact CD1-CG 4.48Å; Y65-L111 HydrophobicContact CE1-CB 4.14Å; Y65-L111 HydrophobicContact CE1-CD2 3.79Å; Y65-L111 HydrophobicContact CE1-CG 3.94Å; G66-L111 VanDerWaalsContact CA-CD2 3.47Å; L111-T115 WeakPolarHBondContact O-CB 3.33Å; L111-T115 VanDerWaalsContact O-CG2 3.25Å; L111-T115 WeakPolarHBondContact O-CG2 3.3Å; L111-T115 PolarHBondContact O-N 2.94Å; L111-T115 PolarHBondContact O-OG1 2.99Å
112	R	89	Confident	89.4	Confident	119 Å²	119	82.8 Å²	82.8	45%	0.449	40%	0.4	S	S	.	.	H	α-helix	trans	-65.2	-40.5	175	-71.2	179	-166.5	-159.9	14.9	111.9	Y65 E108 G109 D110 T115 N116	Y65-R112 HydrophobicContact CD1-CG 3.58Å; Y65-R112 HydrophobicContact CE1-CB 4.46Å; Y65-R112 HydrophobicContact CE1-CG 3.34Å; Y65-R112 HydrophobicContact CG-CG 4.38Å; E108-R112 WeakPolarHBondContact O-CB 3.3Å; E108-R112 WeakPolarHBondContact O-CG 3.26Å; E108-R112 PolarHBondContact O-N 2.75Å; E108-R112 VanDerWaalsContact O-N 3.07Å; E108-R112 IonicContact OE2-CZ 3.32Å; E108-R112 IonicContact OE2-NE 2.71Å; E108-R112 IonicContact OE2-NH2 3.74Å; E108-R112 PolarHBondContact OE2-NH2 3.23Å; G109-R112 PolarHBondContact O-N 3.07Å; D110-R112 VanDerWaalsContact C-N 3.33Å; D110-R112 PolarHBondContact O-N 2.9Å; R112-T115 WeakPolarHBondContact CA-OG1 3.35Å; R112-T115 PolarHBondContact O-OG1 3.15Å; R112-N116 VanDerWaalsContact O-CB 3.3Å; R112-N116 WeakPolarHBondContact O-CB 3.45Å; R112-N116 PolarHBondContact O-N 2.91Å; R112-N116 PolarHBondContact O-ND2 2.9Å
113	R	91.2	Very high	89.6	Confident	159 Å²	159	84.5 Å²	84.5	60%	0.6	41%	0.407	S	S	*	.	H	α-helix	trans	-63	-49.9	176.3	-78.7	-173.8	-73.1	-175.6	-6.7	110.9	G109 D110 T115 N116 L117	G109-R113 VanDerWaalsContact O-CB 3.31Å; G109-R113 WeakPolarHBondContact O-CB 3.31Å; G109-R113 WeakPolarHBondContact O-CG 3.25Å; G109-R113 PolarHBondContact O-N 2.87Å; D110-R113 PolarHBondContact O-N 3.3Å; D110-R113 IonicContact OD1-CZ 2.69Å; D110-R113 IonicContact OD1-NE 3.61Å; D110-R113 IonicContact OD1-NH2 3.06Å; D110-R113 PolarHBondContact OD1-NH2 3.45Å; R113-T115 PolarHBondContact O-N 3.25Å; R113-N116 PolarHBondContact O-N 2.91Å; R113-L117 WeakPolarHBondContact O-CB 3.49Å; R113-L117 VanDerWaalsContact O-CG 3.31Å; R113-L117 WeakPolarHBondContact O-CG 3.38Å; R113-L117 PolarHBondContact O-N 2.89Å
114	E	91.1	Very high	89.8	Confident	76 Å²	76	85.3 Å²	85.3	36%	0.355	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-45.6	-179.7	-173.2	176.1	158.6	0	0	112	K106 D110 N116 L117 N118	K106-E114 WeakPolarHBondContact CD-OE2 3.47Å; K106-E114 IonicContact NZ-OE2 3.52Å; K106-E114 PolarHBondContact NZ-OE2 3.21Å; D110-E114 WeakPolarHBondContact O-CB 3.45Å; D110-E114 PolarHBondContact O-N 3.31Å; E114-N116 VanDerWaalsContact C-N 3.35Å; E114-N116 PolarHBondContact O-N 3.04Å; E114-L117 PolarHBondContact O-N 3.24Å; E114-N118 WeakPolarHBondContact O-CB 3.43Å; E114-N118 PolarHBondContact O-N 3.03Å; E114-N118 PolarHBondContact O-ND2 3.45Å; E114-N118 VanDerWaalsContact O-ND2 3.15Å
115	T	91.3	Very high	90.1	Very high	50 Å²	50	84.1 Å²	84.1	31%	0.307	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-41.2	176.9	51.3	0	0	0	0	112.2	L111 R112 R113 N118 I119	L111-T115 WeakPolarHBondContact O-CB 3.33Å; L111-T115 VanDerWaalsContact O-CG2 3.25Å; L111-T115 WeakPolarHBondContact O-CG2 3.3Å; L111-T115 PolarHBondContact O-N 2.94Å; L111-T115 PolarHBondContact O-OG1 2.99Å; R112-T115 WeakPolarHBondContact CA-OG1 3.35Å; R112-T115 PolarHBondContact O-OG1 3.15Å; R113-T115 PolarHBondContact O-N 3.25Å; T115-N118 PolarHBondContact O-N 2.85Å; T115-I119 WeakPolarHBondContact O-CG1 3.32Å; T115-I119 PolarHBondContact O-N 3.4Å
116	N	92	Very high	90.3	Very high	92 Å²	92	82 Å²	82	49%	0.492	40%	0.403	S	S	.	.	H	α-helix	trans	-65.1	-42.3	175.5	-75.2	-29.3	0	0	0	112.2	R112 R113 E114 N118 I119 K120	R112-N116 VanDerWaalsContact O-CB 3.3Å; R112-N116 WeakPolarHBondContact O-CB 3.45Å; R112-N116 PolarHBondContact O-N 2.91Å; R112-N116 PolarHBondContact O-ND2 2.9Å; R113-N116 PolarHBondContact O-N 2.91Å; E114-N116 VanDerWaalsContact C-N 3.35Å; E114-N116 PolarHBondContact O-N 3.04Å; N116-N118 VanDerWaalsContact C-N 3.35Å; N116-I119 PolarHBondContact O-N 3.4Å; N116-K120 WeakPolarHBondContact O-CG 3.45Å; N116-K120 PolarHBondContact O-N 3.33Å
117	L	93.8	Very high	90.7	Very high	111 Å²	111	77.7 Å²	77.7	58%	0.581	39%	0.389	S	S	*	.	H	α-helix	trans	-61.8	-42.7	175.3	-72.7	172.6	0	0	0	111.5	R113 E114 I119 K120 R121	R113-L117 WeakPolarHBondContact O-CB 3.49Å; R113-L117 VanDerWaalsContact O-CG 3.31Å; R113-L117 WeakPolarHBondContact O-CG 3.38Å; R113-L117 PolarHBondContact O-N 2.89Å; E114-L117 PolarHBondContact O-N 3.24Å; L117-I119 VanDerWaalsContact C-N 3.32Å; L117-I119 PolarHBondContact O-N 2.83Å; L117-K120 PolarHBondContact O-N 3.07Å; L117-R121 WeakPolarHBondContact O-CB 3.4Å; L117-R121 PolarHBondContact O-N 3.2Å
118	N	92.8	Very high	91	Very high	59 Å²	59	83 Å²	83	32%	0.316	41%	0.407	S	S	.	.	H	α-helix	trans	-61.5	-39.2	174.9	-75.8	-39	0	0	0	112.3	E114 T115 N116 R121 L122	E114-N118 WeakPolarHBondContact O-CB 3.43Å; E114-N118 PolarHBondContact O-N 3.03Å; E114-N118 PolarHBondContact O-ND2 3.45Å; E114-N118 VanDerWaalsContact O-ND2 3.15Å; T115-N118 PolarHBondContact O-N 2.85Å; N116-N118 VanDerWaalsContact C-N 3.35Å; N118-R121 PolarHBondContact OD1-NH1 3.03Å; N118-R121 VanDerWaalsContact OD1-NH1 3.16Å; N118-L122 WeakPolarHBondContact O-CG 3.42Å; N118-L122 PolarHBondContact O-N 3.23Å; N118-L122 VanDerWaalsContact O-N 3.07Å
119	I	91.7	Very high	91.5	Very high	53 Å²	53	85.7 Å²	85.7	27%	0.272	41%	0.414	S	S	.	.	H	α-helix	trans	-67.2	-43.7	175.2	-67.1	165.4	0	0	0	110.9	T115 N116 L117 L122 M123 H133	T115-I119 WeakPolarHBondContact O-CG1 3.32Å; T115-I119 PolarHBondContact O-N 3.4Å; N116-I119 PolarHBondContact O-N 3.4Å; L117-I119 VanDerWaalsContact C-N 3.32Å; L117-I119 PolarHBondContact O-N 2.83Å; I119-L122 PolarHBondContact O-N 2.91Å; I119-M123 HydrophobicContact CG2-SD 4.16Å; I119-M123 WeakPolarHBondContact O-CG 3.37Å; I119-M123 PolarHBondContact O-N 2.99Å; I119-H133 HydrophobicContact CG2-CB 4.1Å
120	K	94	Very high	92	Very high	94 Å²	94	83.9 Å²	83.9	41%	0.409	40%	0.396	S	S	.	.	H	α-helix	trans	-58.7	-47.3	175.4	-74.6	-178.5	178.6	-175.4	0	110.9	N116 L117 L122 M123 E124	N116-K120 WeakPolarHBondContact O-CG 3.45Å; N116-K120 PolarHBondContact O-N 3.33Å; L117-K120 PolarHBondContact O-N 3.07Å; K120-L122 VanDerWaalsContact C-N 3.34Å; K120-L122 PolarHBondContact O-N 3.16Å; K120-M123 WeakPolarHBondContact O-CA 3.49Å; K120-M123 WeakPolarHBondContact O-CB 3.39Å; K120-M123 PolarHBondContact O-N 2.86Å; K120-E124 WeakPolarHBondContact O-CG 3.34Å; K120-E124 PolarHBondContact O-N 3.5Å
121	R	95.4	Very high	92.2	Very high	138 Å²	138	82.9 Å²	82.9	52%	0.521	39%	0.39	S	S	.	.	H	α-helix	trans	-53.5	-48.1	174.3	-168.9	-176.2	89.2	-153.5	10.1	112.1	L117 N118 M123 E124 I125	L117-R121 WeakPolarHBondContact O-CB 3.4Å; L117-R121 PolarHBondContact O-N 3.2Å; N118-R121 PolarHBondContact OD1-NH1 3.03Å; N118-R121 VanDerWaalsContact OD1-NH1 3.16Å; R121-M123 VanDerWaalsContact C-N 3.28Å; R121-M123 PolarHBondContact O-N 3.23Å; R121-E124 PolarHBondContact O-N 3.31Å; R121-I125 HydrophobicContact CG-CD1 3.93Å; R121-I125 VanDerWaalsContact O-CG1 3.28Å; R121-I125 WeakPolarHBondContact O-CG1 3.38Å; R121-I125 PolarHBondContact O-N 3.49Å
122	L	93.3	Very high	92.5	Very high	33 Å²	33	81.8 Å²	81.8	17%	0.173	38%	0.383	C	S	.	.	H	α-helix	trans	-62.3	-35.3	177.7	-72.4	173.5	0	0	0	112.8	N118 I119 K120 G126 S127 R129 G130	N118-L122 WeakPolarHBondContact O-CG 3.42Å; N118-L122 PolarHBondContact O-N 3.23Å; N118-L122 VanDerWaalsContact O-N 3.07Å; I119-L122 PolarHBondContact O-N 2.91Å; K120-L122 VanDerWaalsContact C-N 3.34Å; K120-L122 PolarHBondContact O-N 3.16Å; L122-G126 PolarHBondContact O-N 3.16Å; L122-S127 PolarHBondContact O-OG 3.35Å; L122-S127 VanDerWaalsContact O-OG 3.08Å; L122-R129 HydrophobicContact CD1-CB 4.38Å; L122-G130 VanDerWaalsContact O-CA 3.29Å; L122-G130 WeakPolarHBondContact O-CA 3.28Å
123	M	91.6	Very high	92.7	Very high	52 Å²	52	77.6 Å²	77.6	26%	0.256	37%	0.368	S	S	.	.	H	α-helix	trans	-72.4	-35.9	178	-73.4	177.2	53.9	0	0	113.1	I119 K120 R121 G126 H133 R134	I119-M123 HydrophobicContact CG2-SD 4.16Å; I119-M123 WeakPolarHBondContact O-CG 3.37Å; I119-M123 PolarHBondContact O-N 2.99Å; K120-M123 WeakPolarHBondContact O-CA 3.49Å; K120-M123 WeakPolarHBondContact O-CB 3.39Å; K120-M123 PolarHBondContact O-N 2.86Å; R121-M123 VanDerWaalsContact C-N 3.28Å; R121-M123 PolarHBondContact O-N 3.23Å; M123-G126 PolarHBondContact O-N 3.09Å; M123-H133 HydrophobicContact CG-CB 4.29Å; M123-H133 HydrophobicContact SD-CB 4.39Å; M123-R134 HydrophobicContact CE-CB 4.03Å; M123-R134 HydrophobicContact CE-CG 4.04Å; M123-R134 PolarHBondContact O-NH2 3.27Å
124	E	93.4	Very high	92.6	Very high	151 Å²	151	76.1 Å²	76.1	71%	0.706	36%	0.362	S	S	*	.	H	α-helix	trans	-70.4	-46	176.8	-74.8	166.6	-166	0	0	111.5	K120 R121 G126	K120-E124 WeakPolarHBondContact O-CG 3.34Å; K120-E124 PolarHBondContact O-N 3.5Å; R121-E124 PolarHBondContact O-N 3.31Å; E124-G126 PolarHBondContact O-N 3.49Å; E124-G126 VanDerWaalsContact O-N 3.08Å
125	I	94.8	Very high	92.4	Very high	117 Å²	117	81 Å²	81	60%	0.6	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.8	174.5	-67.7	168.1	0	0	0	111.5	R121 S127	R121-I125 HydrophobicContact CG-CD1 3.93Å; R121-I125 VanDerWaalsContact O-CG1 3.28Å; R121-I125 WeakPolarHBondContact O-CG1 3.38Å; R121-I125 PolarHBondContact O-N 3.49Å; I125-S127 PolarHBondContact O-N 3.37Å
126	G	89.9	Confident	92.2	Very high	34 Å²	34	79.4 Å²	79.4	35%	0.351	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	15	-177.4	0	0	0	0	0	113.6	L122 M123 E124 I131	L122-G126 PolarHBondContact O-N 3.16Å; M123-G126 PolarHBondContact O-N 3.09Å; E124-G126 PolarHBondContact O-N 3.49Å; E124-G126 VanDerWaalsContact O-N 3.08Å; G126-I131 WeakPolarHBondContact O-CD1 3.29Å
127	S	92.7	Very high	92	Very high	35 Å²	35	76.1 Å²	76.1	25%	0.245	35%	0.353	C	S	.	.			trans	-54	155.2	173.6	68.8	0	0	0	0	111.7	L122 I125 R129 G130 I131	L122-S127 PolarHBondContact O-OG 3.35Å; L122-S127 VanDerWaalsContact O-OG 3.08Å; I125-S127 PolarHBondContact O-N 3.37Å; S127-R129 PolarHBondContact O-N 3.07Å; S127-R129 VanDerWaalsContact O-N 3.16Å; S127-G130 WeakPolarHBondContact O-CA 3.28Å; S127-G130 PolarHBondContact O-N 3.37Å; S127-G130 PolarHBondContact OG-N 3.29Å; S127-I131 PolarHBondContact O-N 3.3Å
128	Y	93.1	Very high	91.9	Very high	136 Å²	136	71.1 Å²	71.1	53%	0.533	33%	0.327	S	S	.	.	H	α-helix	trans	-50.7	-44.1	176.4	177.6	-110.4	0	0	0	112.1	G130 I131 R132	Y128-G130 PolarHBondContact O-N 2.92Å; Y128-I131 PolarHBondContact O-N 2.94Å; Y128-R132 HydrophobicContact CD1-CG 4.31Å; Y128-R132 HydrophobicContact CD2-CG 4.35Å; Y128-R132 HydrophobicContact CE1-CG 4Å; Y128-R132 HydrophobicContact CE2-CG 4.02Å; Y128-R132 HydrophobicContact CG-CG 4.49Å; Y128-R132 WeakPolarHBondContact O-CG 3.4Å; Y128-R132 PolarHBondContact O-N 3.16Å; Y128-R132 PolarHBondContact OH-NH1 3.45Å
129	R	93.4	Very high	91.7	Very high	124 Å²	124	69.5 Å²	69.5	47%	0.468	32%	0.319	S	S	.	.	H	α-helix	trans	-59.3	-45.1	175.8	-66.1	-179.8	65.9	-179.4	-2.1	111.6	L122 S127 R132 H133	L122-R129 HydrophobicContact CD1-CB 4.38Å; S127-R129 PolarHBondContact O-N 3.07Å; S127-R129 VanDerWaalsContact O-N 3.16Å; R129-R132 PolarHBondContact O-N 3.26Å; R129-H133 PolarHBondContact O-CD2 3.08Å; R129-H133 PolarHBondContact O-N 3.03Å
130	G	93.8	Very high	91.5	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-47.8	175.6	0	0	0	0	0	113.5	L122 S127 Y128 R132 H133 R134	L122-G130 VanDerWaalsContact O-CA 3.29Å; L122-G130 WeakPolarHBondContact O-CA 3.28Å; S127-G130 WeakPolarHBondContact O-CA 3.28Å; S127-G130 PolarHBondContact O-N 3.37Å; S127-G130 PolarHBondContact OG-N 3.29Å; Y128-G130 PolarHBondContact O-N 2.92Å; G130-R132 VanDerWaalsContact C-N 3.27Å; G130-R132 PolarHBondContact O-N 3.04Å; G130-H133 PolarHBondContact O-N 3.33Å; G130-R134 PolarHBondContact O-N 2.89Å
131	I	91.5	Very high	91	Very high	59 Å²	59	75.6 Å²	75.6	30%	0.303	35%	0.354	S	S	.	.	H	α-helix	trans	-60.2	-40.3	177.1	-62.2	170.3	0	0	0	110.6	G126 S127 Y128 R134 R135	G126-I131 WeakPolarHBondContact O-CD1 3.29Å; S127-I131 PolarHBondContact O-N 3.3Å; Y128-I131 PolarHBondContact O-N 2.94Å; I131-R134 PolarHBondContact O-N 2.95Å; I131-R135 WeakPolarHBondContact O-CG 3.38Å; I131-R135 PolarHBondContact O-N 2.89Å
132	R	93.7	Very high	90.5	Very high	26 Å²	26	74 Å²	74	10%	0.098	35%	0.353	C	S	.	.	H	α-helix	trans	-67.4	-41.8	177.3	-64.2	-71.5	-70.7	-133.9	-9.5	111.9	Y128 R129 G130 R134 R135 G136 L137 P138 T139 T144	Y128-R132 HydrophobicContact CD1-CG 4.31Å; Y128-R132 HydrophobicContact CD2-CG 4.35Å; Y128-R132 HydrophobicContact CE1-CG 4Å; Y128-R132 HydrophobicContact CE2-CG 4.02Å; Y128-R132 HydrophobicContact CG-CG 4.49Å; Y128-R132 WeakPolarHBondContact O-CG 3.4Å; Y128-R132 PolarHBondContact O-N 3.16Å; Y128-R132 PolarHBondContact OH-NH1 3.45Å; R129-R132 PolarHBondContact O-N 3.26Å; G130-R132 VanDerWaalsContact C-N 3.27Å; G130-R132 PolarHBondContact O-N 3.04Å; R132-R134 PolarHBondContact O-N 3.45Å; R132-R135 PolarHBondContact O-N 3.33Å; R132-G136 PolarHBondContact O-N 3.45Å; R132-G136 VanDerWaalsContact O-N 3.11Å; R132-L137 HydrophobicContact CB-CB 4.34Å; R132-L137 VanDerWaalsContact NE-CB 3.31Å; R132-L137 PolarHBondContact O-N 3.08Å; R132-P138 VanDerWaalsContact CZ-O 3.27Å; R132-P138 PolarHBondContact NE-O 3.35Å; R132-P138 PolarHBondContact NH2-O 3.11Å; R132-T139 HydrophobicContact CB-CG2 3.72Å; R132-T144 VanDerWaalsContact CZ-CG2 3.4Å
133	H	91.5	Very high	90	Very high	31 Å²	31	78.2 Å²	78.2	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-58.6	-45.8	171.8	-82.1	-73	0	0	0	111.7	I119 M123 R129 G130 R135 G136 T139 R151	I119-H133 HydrophobicContact CG2-CB 4.1Å; M123-H133 HydrophobicContact CG-CB 4.29Å; M123-H133 HydrophobicContact SD-CB 4.39Å; R129-H133 PolarHBondContact O-CD2 3.08Å; R129-H133 PolarHBondContact O-N 3.03Å; G130-H133 PolarHBondContact O-N 3.33Å; H133-R135 VanDerWaalsContact C-N 3.31Å; H133-R135 PolarHBondContact O-N 3.35Å; H133-G136 PolarHBondContact O-N 3.44Å; H133-T139 VanDerWaalsContact CD2-CG2 3.4Å; H133-T139 WeakPolarHBondContact CD2-CG2 3.44Å; H133-T139 VanDerWaalsContact NE2-CG2 3.34Å; H133-T139 WeakPolarHBondContact NE2-CG2 3.37Å; H133-R151 PolarHBondContact ND1-NH2 3.17Å
134	R	89	Confident	89.6	Confident	127 Å²	127	77.9 Å²	77.9	48%	0.479	38%	0.377	S	S	.	.	H	α-helix	trans	-58.8	-40.2	177.4	-167.5	-176.3	-59.6	179.6	2	112.6	M123 G130 I131 R132 G136	M123-R134 HydrophobicContact CE-CB 4.03Å; M123-R134 HydrophobicContact CE-CG 4.04Å; M123-R134 PolarHBondContact O-NH2 3.27Å; G130-R134 PolarHBondContact O-N 2.89Å; I131-R134 PolarHBondContact O-N 2.95Å; R132-R134 PolarHBondContact O-N 3.45Å; R134-G136 VanDerWaalsContact C-N 3.3Å; R134-G136 PolarHBondContact O-N 3.48Å
135	R	87.4	Confident	89	Confident	179 Å²	179	79.8 Å²	79.8	68%	0.675	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-1.4	178.3	-65.9	178.5	-175.6	-179.1	3	113.9	I131 R132 H133 L137	I131-R135 WeakPolarHBondContact O-CG 3.38Å; I131-R135 PolarHBondContact O-N 2.89Å; R132-R135 PolarHBondContact O-N 3.33Å; H133-R135 VanDerWaalsContact C-N 3.31Å; H133-R135 PolarHBondContact O-N 3.35Å; R135-L137 VanDerWaalsContact C-N 3.3Å; R135-L137 HydrophobicContact CB-CD1 3.92Å; R135-L137 HydrophobicContact CB-CG 3.95Å; R135-L137 PolarHBondContact O-N 3.43Å
136	G	87.2	Confident	88.4	Confident	16 Å²	16	80.1 Å²	80.1	17%	0.165	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	31.9	-175.1	0	0	0	0	0	113.2	R132 H133 R134 R151 K152	R132-G136 PolarHBondContact O-N 3.45Å; R132-G136 VanDerWaalsContact O-N 3.11Å; H133-G136 PolarHBondContact O-N 3.44Å; R134-G136 VanDerWaalsContact C-N 3.3Å; R134-G136 PolarHBondContact O-N 3.48Å; G136-R151 CarbonylContact O-C 3.31Å; G136-R151 VanDerWaalsContact O-C 3.31Å; G136-R151 VanDerWaalsContact O-O 3.13Å; G136-K152 VanDerWaalsContact O-CA 3.29Å; G136-K152 WeakPolarHBondContact O-CA 3.49Å; G136-K152 PolarHBondContact O-N 2.9Å
137	L	89.1	Confident	87.9	Confident	24 Å²	24	84.5 Å²	84.5	13%	0.126	40%	0.401	C	S	.	.			trans	-104.5	154.5	-179.8	-63.2	175.1	0	0	0	111.2	R132 R135 T144 K152	R132-L137 HydrophobicContact CB-CB 4.34Å; R132-L137 VanDerWaalsContact NE-CB 3.31Å; R132-L137 PolarHBondContact O-N 3.08Å; R135-L137 VanDerWaalsContact C-N 3.3Å; R135-L137 HydrophobicContact CB-CD1 3.92Å; R135-L137 HydrophobicContact CB-CG 3.95Å; R135-L137 PolarHBondContact O-N 3.43Å; L137-T144 HydrophobicContact CB-CG2 4.43Å; L137-T144 HydrophobicContact CD1-CG2 4.35Å; L137-T144 HydrophobicContact CD2-CG2 4.05Å; L137-K152 HydrophobicContact CD2-CD 4.05Å; L137-K152 HydrophobicContact CD2-CG 3.74Å
138	P	91.3	Very high	87.4	Confident	6 Å²	6	83.1 Å²	83.1	4%	0.039	39%	0.391	C	S	.	.			trans	-56.7	142.8	170.5	-24.1	33.2	0	0	0	111.9	R132 Q142 A148 R151	R132-P138 VanDerWaalsContact CZ-O 3.27Å; R132-P138 PolarHBondContact NE-O 3.35Å; R132-P138 PolarHBondContact NH2-O 3.11Å; P138-Q142 HydrophobicContact CB-CB 3.92Å; P138-Q142 HydrophobicContact CB-CG 4.49Å; P138-Q142 HydrophobicContact CG-CB 4.43Å; P138-A148 HydrophobicContact CG-CB 3.9Å; P138-R151 HydrophobicContact CG-CB 4.05Å; P138-R151 HydrophobicContact CG-CG 4.46Å
139	T	88.9	Confident	87	Confident	24 Å²	24	84.9 Å²	84.9	15%	0.147	40%	0.397	C	S	.	.	S	Bend	trans	-105	-12.2	-172.5	56.5	0	0	0	0	114.5	R132 H133 G141	R132-T139 HydrophobicContact CB-CG2 3.72Å; H133-T139 VanDerWaalsContact CD2-CG2 3.4Å; H133-T139 WeakPolarHBondContact CD2-CG2 3.44Å; H133-T139 VanDerWaalsContact NE2-CG2 3.34Å; H133-T139 WeakPolarHBondContact NE2-CG2 3.37Å; T139-G141 PolarHBondContact O-N 3.3Å
140	R	87.5	Confident	86.5	Confident	217 Å²	217	86.1 Å²	86.1	82%	0.819	42%	0.419	S	S	*	.	S	Bend	trans	-96.8	34.9	-176.2	-60	-176.5	179.1	174.9	-1.1	113.7	Q142	R140-Q142 VanDerWaalsContact C-N 3.29Å; R140-Q142 PolarHBondContact O-N 3.03Å
141	G	82.4	Confident	86.1	Confident	58 Å²	58	92 Å²	92	60%	0.598	44%	0.441	S	S	*	.	S	Bend	trans	75.3	6.4	177.2	0	0	0	0	0	116.5	T139	T139-G141 PolarHBondContact O-N 3.3Å
142	Q	85.3	Confident	85.7	Confident	106 Å²	106	93.9 Å²	93.9	50%	0.495	45%	0.447	S	S	.	.			trans	-66.5	144.6	-179.7	-62.6	169.9	-9.2	0	0	112.7	P138 R140 T144	P138-Q142 HydrophobicContact CB-CB 3.92Å; P138-Q142 HydrophobicContact CB-CG 4.49Å; P138-Q142 HydrophobicContact CG-CB 4.43Å; R140-Q142 VanDerWaalsContact C-N 3.29Å; R140-Q142 PolarHBondContact O-N 3.03Å; Q142-T144 PolarHBondContact O-N 3.21Å
143	N	83.3	Confident	85.2	Confident	121 Å²	121	93.7 Å²	93.7	65%	0.647	45%	0.454	S	S	*	.			trans	-62.6	114.7	179.2	-76.1	-17.1	0	0	0	111.9	K145 N147	N143-K145 VanDerWaalsContact C-N 3.34Å; N143-K145 PolarHBondContact O-N 2.88Å; N143-N147 PolarHBondContact O-N 2.84Å
144	T	82.3	Confident	84.8	Confident	44 Å²	44	97.1 Å²	97.1	27%	0.27	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-19.7	-174.7	59.3	0	0	0	0	114.8	R132 L137 Q142 A148 K152	R132-T144 VanDerWaalsContact CZ-CG2 3.4Å; L137-T144 HydrophobicContact CB-CG2 4.43Å; L137-T144 HydrophobicContact CD1-CG2 4.35Å; L137-T144 HydrophobicContact CD2-CG2 4.05Å; Q142-T144 PolarHBondContact O-N 3.21Å; T144-A148 WeakPolarHBondContact O-CB 3.29Å; T144-K152 WeakPolarHBondContact O-CE 3.48Å; T144-K152 PolarHBondContact O-NZ 3.16Å
145	K	80.7	Confident	84.2	Confident	191 Å²	191	95.6 Å²	95.6	83%	0.83	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-50.5	-175.9	-170.6	178.7	-179.3	-178	0	110.9	N143	N143-K145 VanDerWaalsContact C-N 3.34Å; N143-K145 PolarHBondContact O-N 2.88Å
146	N	82.3	Confident	83.7	Confident	125 Å²	125	97.6 Å²	97.6	67%	0.668	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-42.7	-171.5	-57.7	50	0	0	0	112.2
147	N	79.7	Confident	83.3	Confident	126 Å²	126	101.7 Å²	101.7	67%	0.674	53%	0.533	S	S	*	.	S	Bend	trans	-119.2	49.1	-164.3	-64.2	-18.3	0	0	0	112.7	N143	N143-N147 PolarHBondContact O-N 2.84Å
148	A	81.6	Confident	82.7	Confident	5 Å²	5	106.7 Å²	106.7	4%	0.041	56%	0.558	C	S	.	*			trans	-125.5	12	-179	0	0	0	0	0	114.7	P138 T144 T150 R151 K152	P138-A148 HydrophobicContact CG-CB 3.9Å; T144-A148 WeakPolarHBondContact O-CB 3.29Å; A148-T150 PolarHBondContact O-N 3.35Å; A148-R151 PolarHBondContact O-N 3.02Å; A148-K152 HydrophobicContact CB-CD 3.86Å; A148-K152 HydrophobicContact CB-CG 4.1Å; A148-K152 VanDerWaalsContact O-CB 3.28Å; A148-K152 WeakPolarHBondContact O-CB 3.46Å; A148-K152 WeakPolarHBondContact O-CG 3.18Å; A148-K152 PolarHBondContact O-N 3.24Å
149	R	84.5	Confident	81.9	Confident	173 Å²	173	111.4 Å²	111.4	65%	0.653	60%	0.597	S	S	*	*	H	α-helix	trans	-60.3	-46.4	-173.6	-175	55.8	175.3	177.5	-7.9	112.8	R151 K152 G153	R149-R151 VanDerWaalsContact C-N 3.28Å; R149-R151 PolarHBondContact O-N 3.32Å; R149-K152 PolarHBondContact O-N 2.98Å; R149-G153 PolarHBondContact NH1-O 3.44Å; R149-G153 PolarHBondContact O-N 3.39Å
150	T	83.1	Confident	81	Confident	151 Å²	151	113.9 Å²	113.9	93%	0.926	63%	0.628	S	S	*	*	H	α-helix	trans	-58.5	-38.4	-178.2	-42.1	0	0	0	0	112.5	A148	A148-T150 PolarHBondContact O-N 3.35Å
151	R	85.2	Confident	79.9	Confident	124 Å²	124	111.9 Å²	111.9	47%	0.468	63%	0.625	S	S	.	*	H	α-helix	trans	-88.8	-39.1	-179	-172.4	58	-177.7	170.3	7.9	113.7	H133 G136 P138 A148 R149 G153	H133-R151 PolarHBondContact ND1-NH2 3.17Å; G136-R151 CarbonylContact O-C 3.31Å; G136-R151 VanDerWaalsContact O-C 3.31Å; G136-R151 VanDerWaalsContact O-O 3.13Å; P138-R151 HydrophobicContact CG-CB 4.05Å; P138-R151 HydrophobicContact CG-CG 4.46Å; A148-R151 PolarHBondContact O-N 3.02Å; R149-R151 VanDerWaalsContact C-N 3.28Å; R149-R151 PolarHBondContact O-N 3.32Å; R151-G153 VanDerWaalsContact C-N 3.25Å; R151-G153 PolarHBondContact O-N 3.3Å
152	K	84.8	Confident	78.7	Confident	97 Å²	97	118.3 Å²	118.3	42%	0.422	64%	0.637	S	S	.	*	H	α-helix	trans	-64.6	-33.4	176.9	-79.1	177.6	171.4	179	0	111.7	G136 L137 T144 A148 R149	G136-K152 VanDerWaalsContact O-CA 3.29Å; G136-K152 WeakPolarHBondContact O-CA 3.49Å; G136-K152 PolarHBondContact O-N 2.9Å; L137-K152 HydrophobicContact CD2-CD 4.05Å; L137-K152 HydrophobicContact CD2-CG 3.74Å; T144-K152 WeakPolarHBondContact O-CE 3.48Å; T144-K152 PolarHBondContact O-NZ 3.16Å; A148-K152 HydrophobicContact CB-CD 3.86Å; A148-K152 HydrophobicContact CB-CG 4.1Å; A148-K152 VanDerWaalsContact O-CB 3.28Å; A148-K152 WeakPolarHBondContact O-CB 3.46Å; A148-K152 WeakPolarHBondContact O-CG 3.18Å; A148-K152 PolarHBondContact O-N 3.24Å; R149-K152 PolarHBondContact O-N 2.98Å
153	G	83	Confident	77.3	Confident	23 Å²	23	126.6 Å²	126.6	24%	0.237	67%	0.671	C	S	.	*			trans	66.7	-169	-175.8	0	0	0	0	0	112.7	R149 R151	R149-G153 PolarHBondContact NH1-O 3.44Å; R149-G153 PolarHBondContact O-N 3.39Å; R151-G153 VanDerWaalsContact C-N 3.25Å; R151-G153 PolarHBondContact O-N 3.3Å
154	P	81.7	Confident	77	Confident	103 Å²	103	126.9 Å²	126.9	67%	0.669	67%	0.672	S	S	*	*	S	Bend	trans	-62.6	153.2	172.8	27.3	-33.2	0	0	0	111	R156	P154-R156 PolarHBondContact O-N 2.72Å
155	A	77.7	Confident	76.7	Confident	95 Å²	95	131.2 Å²	131.2	79%	0.785	69%	0.693	S	S	*	*			trans	-60.9	130.5	175.9	0	0	0	0	0	109.1	A157	A155-A157 PolarHBondContact O-N 2.78Å; A155-A157 VanDerWaalsContact O-N 3.09Å
156	R	75.5	Confident	76.5	Confident	221 Å²	221	127.9 Å²	127.9	83%	0.834	69%	0.686	S	S	*	*			trans	-64.4	114.5	176.7	-66.7	-176.2	-179.6	-144.5	-0.9	108	P154 I158	P154-R156 PolarHBondContact O-N 2.72Å; R156-I158 PolarHBondContact O-N 2.91Å
157	A	78.8	Confident	76.2	Confident	101 Å²	101	128.1 Å²	128.1	84%	0.835	69%	0.687	S	S	*	*			trans	-58.9	123.4	170.7	0	0	0	0	0	108	A155 A159	A155-A157 PolarHBondContact O-N 2.78Å; A155-A157 VanDerWaalsContact O-N 3.09Å; A157-A159 PolarHBondContact O-N 3.03Å
158	I	77.8	Confident	76	Confident	130 Å²	130	128.2 Å²	128.2	67%	0.667	69%	0.687	S	S	*	*			trans	-79.8	112.2	173.7	-59.8	172.9	0	0	0	105.7	R156 G160 K161	R156-I158 PolarHBondContact O-N 2.91Å; I158-G160 PolarHBondContact O-N 3.26Å; I158-G160 VanDerWaalsContact O-N 3.16Å; I158-K161 PolarHBondContact O-N 3.45Å
159	A	74.3	Confident	75.6	Confident	104 Å²	104	136.4 Å²	136.4	86%	0.86	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	121.4	173	0	0	0	0	0	108.7	A157	A157-A159 PolarHBondContact O-N 3.03Å
160	G	69.8	Low	75	Confident	76 Å²	76	133.8 Å²	133.8	78%	0.784	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.3	14.6	179.3	0	0	0	0	0	116.5	I158 K162	I158-G160 PolarHBondContact O-N 3.26Å; I158-G160 VanDerWaalsContact O-N 3.16Å; G160-K162 VanDerWaalsContact C-N 3.33Å; G160-K162 PolarHBondContact O-N 3.22Å
161	K	63.9	Low	74.3	Confident	176 Å²	176	132.5 Å²	132.5	77%	0.765	72%	0.721	S	S	*	*			trans	-66.4	94.8	167.6	-164	178.9	-175.4	-169.8	0	109.2	I158 K163	I158-K161 PolarHBondContact O-N 3.45Å; K161-K163 PolarHBondContact O-N 3.45Å
162	K	57	Low	73.4	Confident	193 Å²	193	133.2 Å²	133.2	84%	0.839	74%	0.742	S	S	*	*			trans	-55.6	136.7	164.5	-78.7	-175.3	176.5	-179	0	107.9	G160	G160-K162 VanDerWaalsContact C-N 3.33Å; G160-K162 PolarHBondContact O-N 3.22Å
163	K	56.8	Low	72.4	Confident	279 Å²	279	136.5 Å²	136.5	100%	1.213	77%	0.772	S	S	*	*			trans	-57.7	0	176.7	-133.8	-178.6	-174.5	-176.3	0	110.3	K161	K161-K163 PolarHBondContact O-N 3.45Å

Retrieved 163 of 163 residues in 40.9 ms (Link to these results)

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