A0A087WYI9_HUMAN Loading...

Cyclin dependent kinase 11B

AlphaFold DB , UniProt , Accession A0A087WYI9, Species HUMAN (Homo sapiens, Human), Gene CDK11B, Length 203 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	48.5	Very low	61.4	Low	254 Å²	254	155.6 Å²	155.6	100%	1.251	79%	0.794	S	S	*	*				0	89.1	0	-61	-77.8	-165.6	0	0	104.9
2	G	49.9	Very low	63	Low	72 Å²	72	149.9 Å²	149.9	74%	0.742	77%	0.772	S	S	*	*				126.2	82	67.6	0	0	0	0	0	104.8	E4	G2-E4 PolarHBondContact O-N 3.28Å
3	D	47.1	Very low	64.1	Low	146 Å²	146	148.9 Å²	148.9	78%	0.781	77%	0.768	S	S	*	*			trans	-85.5	84.1	-177.9	-145.2	27.6	0	0	0	107.4	K5	D3-K5 PolarHBondContact O-N 3.16Å
4	E	63.8	Low	65.7	Low	183 Å²	183	145.3 Å²	145.3	86%	0.855	75%	0.751	S	S	*	*			trans	-73.6	81.1	172.9	-71	178.4	171.9	0	0	108.5	G2 D6	G2-E4 PolarHBondContact O-N 3.28Å; E4-D6 PolarHBondContact O-N 3.49Å; E4-D6 VanDerWaalsContact O-N 3.14Å
5	K	57.8	Low	67.1	Low	171 Å²	171	142.1 Å²	142.1	74%	0.743	73%	0.731	S	S	*	*			trans	-64.1	112.8	163.7	-73.7	-179.3	178.8	177.8	0	107.5	D3 S7	D3-K5 PolarHBondContact O-N 3.16Å; K5-S7 PolarHBondContact O-N 3.01Å
6	D	59	Low	68.3	Low	143 Å²	143	137.9 Å²	137.9	77%	0.765	71%	0.709	S	S	*	*			trans	-54.5	90.3	165.6	-81.7	-38.2	0	0	0	109.3	E4 W8	E4-D6 PolarHBondContact O-N 3.49Å; E4-D6 VanDerWaalsContact O-N 3.14Å; D6-W8 VanDerWaalsContact C-N 3.3Å; D6-W8 VanDerWaalsContact O-CD1 3.31Å; D6-W8 PolarHBondContact O-N 3.43Å
7	S	51.3	Low	69.3	Low	99 Å²	99	135.2 Å²	135.2	69%	0.692	70%	0.696	S	S	*	*			trans	-74.7	89	173.6	-178.7	0	0	0	0	107	K5 K9	K5-S7 PolarHBondContact O-N 3.01Å; S7-K9 VanDerWaalsContact C-N 3.3Å; S7-K9 PolarHBondContact O-N 3.39Å
8	W	69.4	Low	70.1	Confident	224 Å²	224	134.6 Å²	134.6	85%	0.848	69%	0.689	S	S	*	*			trans	-62.2	98	171.2	-70.6	32.2	0	0	0	107.2	D6 V10	D6-W8 VanDerWaalsContact C-N 3.3Å; D6-W8 VanDerWaalsContact O-CD1 3.31Å; D6-W8 PolarHBondContact O-N 3.43Å; W8-V10 PolarHBondContact O-N 2.94Å
9	K	71.4	Confident	70.7	Confident	190 Å²	190	131.7 Å²	131.7	83%	0.826	67%	0.673	S	S	*	*			trans	-65.7	102.4	173.4	-80.2	-175.6	177.1	179.7	0	107.2	S7 K11	S7-K9 VanDerWaalsContact C-N 3.3Å; S7-K9 PolarHBondContact O-N 3.39Å; K9-K11 PolarHBondContact O-N 3.49Å; K9-K11 VanDerWaalsContact O-N 3.13Å
10	V	77.3	Confident	71.3	Confident	134 Å²	134	132.3 Å²	132.3	81%	0.812	67%	0.67	S	S	*	*			trans	-61.6	115.4	171.4	178	0	0	0	0	106.8	W8 T12	W8-V10 PolarHBondContact O-N 2.94Å; V10-T12 PolarHBondContact O-N 2.98Å
11	K	79.8	Confident	71.8	Confident	96 Å²	96	132.7 Å²	132.7	42%	0.417	67%	0.668	S	S	.	*			trans	-56.6	133.1	175.4	-71.1	179.5	174.7	176.9	0	108.8	K9 E15 I16 E19	K9-K11 PolarHBondContact O-N 3.49Å; K9-K11 VanDerWaalsContact O-N 3.13Å; K11-E15 WeakPolarHBondContact CA-OE2 3.47Å; K11-E15 HydrophobicContact CB-CB 4.4Å; K11-I16 HydrophobicContact CB-CD1 4.26Å; K11-I16 HydrophobicContact CB-CG1 3.84Å; K11-E19 IonicContact NZ-OE1 3.11Å; K11-E19 IonicContact NZ-OE2 3.48Å; K11-E19 PolarHBondContact NZ-OE2 2.87Å
12	T	80.4	Confident	73.2	Confident	87 Å²	87	127.8 Å²	127.8	53%	0.534	64%	0.635	S	S	.	*			trans	-67.1	156	176.1	62.7	0	0	0	0	109.7	V10 D14 E15 I16	V10-T12 PolarHBondContact O-N 2.98Å; T12-D14 PolarHBondContact O-N 2.78Å; T12-E15 PolarHBondContact N-OE2 3.44Å; T12-E15 WeakPolarHBondContact O-CB 3.27Å; T12-E15 PolarHBondContact O-N 2.99Å; T12-I16 WeakPolarHBondContact O-CG1 3.4Å; T12-I16 PolarHBondContact O-N 3.3Å
13	L	77.8	Confident	74.3	Confident	137 Å²	137	132.5 Å²	132.5	72%	0.717	63%	0.631	S	S	*	*	H	α-helix	trans	-53.6	-39.1	179.1	-171.3	101.7	0	0	0	111.6	I16 L17	L13-I16 PolarHBondContact O-N 2.84Å; L13-L17 HydrophobicContact CD2-CD1 4.07Å; L13-L17 HydrophobicContact CG-CD1 4.36Å; L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.34Å; L13-L17 PolarHBondContact O-N 3.44Å
14	D	86.3	Confident	75.6	Confident	98 Å²	98	132.5 Å²	132.5	52%	0.524	62%	0.624	S	S	.	*	H	α-helix	trans	-64.7	-41.8	179.3	-164	55.2	0	0	0	112	T12 I16 L17 Q18	T12-D14 PolarHBondContact O-N 2.78Å; D14-I16 VanDerWaalsContact C-N 3.33Å; D14-I16 PolarHBondContact O-N 3.27Å; D14-L17 PolarHBondContact O-N 3.34Å; D14-Q18 WeakPolarHBondContact O-CG 3.38Å; D14-Q18 PolarHBondContact O-N 2.94Å; D14-Q18 PolarHBondContact OD2-NE2 3.48Å
15	E	86.7	Confident	75.8	Confident	98 Å²	98	129.2 Å²	129.2	46%	0.458	61%	0.608	S	S	.	*	H	α-helix	trans	-64.2	-37.2	176.5	-159.2	174.9	-171	0	0	111.9	K11 T12 E19	K11-E15 WeakPolarHBondContact CA-OE2 3.47Å; K11-E15 HydrophobicContact CB-CB 4.4Å; T12-E15 PolarHBondContact N-OE2 3.44Å; T12-E15 WeakPolarHBondContact O-CB 3.27Å; T12-E15 PolarHBondContact O-N 2.99Å; E15-E19 WeakPolarHBondContact O-CB 3.19Å; E15-E19 PolarHBondContact O-N 3.11Å
16	I	85.9	Confident	76.1	Confident	75 Å²	75	126.8 Å²	126.8	39%	0.385	60%	0.6	S	S	.	*	H	α-helix	trans	-68.5	-39	174.4	-63.3	169.4	0	0	0	111.1	K11 T12 L13 D14 E19 K20	K11-I16 HydrophobicContact CB-CD1 4.26Å; K11-I16 HydrophobicContact CB-CG1 3.84Å; T12-I16 WeakPolarHBondContact O-CG1 3.4Å; T12-I16 PolarHBondContact O-N 3.3Å; L13-I16 PolarHBondContact O-N 2.84Å; D14-I16 VanDerWaalsContact C-N 3.33Å; D14-I16 PolarHBondContact O-N 3.27Å; I16-E19 PolarHBondContact O-N 3.01Å; I16-K20 WeakPolarHBondContact O-CB 3.43Å; I16-K20 WeakPolarHBondContact O-CG 3.43Å; I16-K20 PolarHBondContact O-N 2.84Å
17	L	86.7	Confident	76.4	Confident	92 Å²	92	125.6 Å²	125.6	48%	0.482	59%	0.589	S	S	.	*	H	α-helix	trans	-68.5	-41.6	177.5	-72.1	174.9	0	0	0	111.5	L13 D14 K20 K21	L13-L17 HydrophobicContact CD2-CD1 4.07Å; L13-L17 HydrophobicContact CG-CD1 4.36Å; L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.34Å; L13-L17 PolarHBondContact O-N 3.44Å; D14-L17 PolarHBondContact O-N 3.34Å; L17-K20 PolarHBondContact O-N 2.91Å; L17-K21 WeakPolarHBondContact O-CB 3.31Å; L17-K21 PolarHBondContact O-N 2.93Å
18	Q	82.9	Confident	76.8	Confident	123 Å²	123	126 Å²	126	58%	0.575	58%	0.58	S	S	*	*	H	α-helix	trans	-64.3	-41.8	173.9	-70.2	-173.3	22	0	0	111.6	D14 K20 K21 R22	D14-Q18 WeakPolarHBondContact O-CG 3.38Å; D14-Q18 PolarHBondContact O-N 2.94Å; D14-Q18 PolarHBondContact OD2-NE2 3.48Å; Q18-K20 PolarHBondContact O-N 3.01Å; Q18-K21 PolarHBondContact O-N 3.08Å; Q18-R22 WeakPolarHBondContact O-CB 3.21Å; Q18-R22 PolarHBondContact O-N 2.85Å
19	E	82.1	Confident	76.7	Confident	80 Å²	80	123.2 Å²	123.2	37%	0.374	57%	0.574	S	S	.	*	H	α-helix	trans	-65.2	-39.2	175.7	-175.1	156.7	-150.2	0	0	112.1	K11 E15 I16 R22 R23	K11-E19 IonicContact NZ-OE1 3.11Å; K11-E19 IonicContact NZ-OE2 3.48Å; K11-E19 PolarHBondContact NZ-OE2 2.87Å; E15-E19 WeakPolarHBondContact O-CB 3.19Å; E15-E19 PolarHBondContact O-N 3.11Å; I16-E19 PolarHBondContact O-N 3.01Å; E19-R22 PolarHBondContact O-N 2.95Å; E19-R23 VanDerWaalsContact O-CB 3.31Å; E19-R23 WeakPolarHBondContact O-CB 3.35Å; E19-R23 PolarHBondContact O-N 3.28Å
20	K	83	Confident	76.2	Confident	144 Å²	144	116.9 Å²	116.9	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-61.6	-42.3	171.1	-85.6	-172.6	173	-178	0	112.1	I16 L17 Q18 R23 K24	I16-K20 WeakPolarHBondContact O-CB 3.43Å; I16-K20 WeakPolarHBondContact O-CG 3.43Å; I16-K20 PolarHBondContact O-N 2.84Å; L17-K20 PolarHBondContact O-N 2.91Å; Q18-K20 PolarHBondContact O-N 3.01Å; K20-R23 PolarHBondContact O-N 3.25Å; K20-K24 WeakPolarHBondContact O-CB 3.42Å; K20-K24 PolarHBondContact O-N 3.2Å
21	K	81.8	Confident	75.1	Confident	141 Å²	141	116.8 Å²	116.8	61%	0.613	55%	0.548	S	S	*	.	H	α-helix	trans	-64.2	-45.8	178.4	-167.3	179	177.8	-175.3	0	111.2	L17 Q18 R23 K24 E25	L17-K21 WeakPolarHBondContact O-CB 3.31Å; L17-K21 PolarHBondContact O-N 2.93Å; Q18-K21 PolarHBondContact O-N 3.08Å; K21-R23 VanDerWaalsContact C-N 3.32Å; K21-R23 PolarHBondContact O-N 3.46Å; K21-K24 PolarHBondContact O-N 3.24Å; K21-E25 PolarHBondContact O-N 3.47Å; K21-E25 VanDerWaalsContact O-N 3.1Å
22	R	77.4	Confident	74.2	Confident	151 Å²	151	116.3 Å²	116.3	57%	0.57	55%	0.549	S	S	*	.	H	α-helix	trans	-61.3	-38.6	175.7	-167.7	-175.1	71.4	149.9	-1.3	112.4	Q18 E19 Q26	Q18-R22 WeakPolarHBondContact O-CB 3.21Å; Q18-R22 PolarHBondContact O-N 2.85Å; E19-R22 PolarHBondContact O-N 2.95Å; R22-Q26 WeakPolarHBondContact O-CG 3.27Å; R22-Q26 PolarHBondContact O-N 3.44Å
23	R	72.7	Confident	73.2	Confident	171 Å²	171	120.1 Å²	120.1	65%	0.645	56%	0.558	S	S	*	*	H	α-helix	trans	-70.4	-39.1	178.2	-164.9	171.5	-177.6	169.3	2.1	112	E19 K20 K21 Q26 E27	E19-R23 VanDerWaalsContact O-CB 3.31Å; E19-R23 WeakPolarHBondContact O-CB 3.35Å; E19-R23 PolarHBondContact O-N 3.28Å; K20-R23 PolarHBondContact O-N 3.25Å; K21-R23 VanDerWaalsContact C-N 3.32Å; K21-R23 PolarHBondContact O-N 3.46Å; R23-Q26 PolarHBondContact O-N 2.88Å; R23-E27 PolarHBondContact O-N 3.29Å; R23-E27 VanDerWaalsContact O-N 3.12Å
24	K	74.3	Confident	72.2	Confident	146 Å²	146	123.3 Å²	123.3	64%	0.635	56%	0.561	S	S	*	*	H	α-helix	trans	-63.5	-41.4	176.4	-169.1	178.4	179.9	-174.4	0	112.4	K20 K21 Q26 E27 E28	K20-K24 WeakPolarHBondContact O-CB 3.42Å; K20-K24 PolarHBondContact O-N 3.2Å; K21-K24 PolarHBondContact O-N 3.24Å; K24-Q26 VanDerWaalsContact C-N 3.31Å; K24-Q26 PolarHBondContact O-N 2.83Å; K24-E27 PolarHBondContact O-N 3.26Å; K24-E28 PolarHBondContact O-N 3.02Å
25	E	67.8	Low	70.9	Confident	113 Å²	113	124.5 Å²	124.5	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-66.9	-30.9	176.5	-75.6	175.6	-173.7	0	0	112.9	K21 K29	K21-E25 PolarHBondContact O-N 3.47Å; K21-E25 VanDerWaalsContact O-N 3.1Å; E25-K29 VanDerWaalsContact O-CB 3.29Å; E25-K29 WeakPolarHBondContact O-CB 3.26Å; E25-K29 PolarHBondContact O-N 3.48Å
26	Q	64.9	Low	69.5	Low	121 Å²	121	127.3 Å²	127.3	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-71.5	-37.1	174	-72.8	-177.1	-6.2	0	0	112.4	R22 R23 K24 A30	R22-Q26 WeakPolarHBondContact O-CG 3.27Å; R22-Q26 PolarHBondContact O-N 3.44Å; R23-Q26 PolarHBondContact O-N 2.88Å; K24-Q26 VanDerWaalsContact C-N 3.31Å; K24-Q26 PolarHBondContact O-N 2.83Å; Q26-A30 VanDerWaalsContact O-CB 3.32Å; Q26-A30 WeakPolarHBondContact O-CB 3.24Å; Q26-A30 PolarHBondContact O-N 2.84Å
27	E	64.1	Low	67.9	Low	118 Å²	118	129.8 Å²	129.8	55%	0.551	59%	0.591	S	S	*	*	H	α-helix	trans	-64.3	-45.1	173.2	-74.4	174.2	-174.7	0	0	110.8	R23 K24 K29 A30 E31	R23-E27 PolarHBondContact O-N 3.29Å; R23-E27 VanDerWaalsContact O-N 3.12Å; K24-E27 PolarHBondContact O-N 3.26Å; E27-K29 PolarHBondContact O-N 2.86Å; E27-A30 PolarHBondContact O-N 2.95Å; E27-E31 WeakPolarHBondContact O-CB 3.35Å; E27-E31 PolarHBondContact O-N 3Å
28	E	60.8	Low	66.3	Low	107 Å²	107	128.6 Å²	128.6	50%	0.5	59%	0.59	S	S	.	*	H	α-helix	trans	-64	-41.8	177.2	-167.8	178.4	168.2	0	0	111.8	K24 A30 E31 I32	K24-E28 PolarHBondContact O-N 3.02Å; E28-A30 VanDerWaalsContact C-N 3.32Å; E28-A30 PolarHBondContact O-N 3.46Å; E28-E31 PolarHBondContact O-N 3.45Å; E28-I32 HydrophobicContact CG-CD1 3.99Å; E28-I32 WeakPolarHBondContact O-CB 3.37Å; E28-I32 WeakPolarHBondContact O-CD1 3.46Å; E28-I32 WeakPolarHBondContact O-CG1 3.49Å; E28-I32 PolarHBondContact O-N 3.09Å
29	K	65.8	Low	64.9	Low	166 Å²	166	128.5 Å²	128.5	72%	0.722	59%	0.594	S	S	*	*	H	α-helix	trans	-65.3	-34.2	175.3	-168.9	173.7	-177.1	176.8	0	112.5	E25 E27 K33	E25-K29 VanDerWaalsContact O-CB 3.29Å; E25-K29 WeakPolarHBondContact O-CB 3.26Å; E25-K29 PolarHBondContact O-N 3.48Å; E27-K29 PolarHBondContact O-N 2.86Å; K29-K33 WeakPolarHBondContact O-CB 3.31Å; K29-K33 PolarHBondContact O-N 3.17Å; K29-K33 VanDerWaalsContact O-N 3.15Å
30	A	61	Low	63.5	Low	56 Å²	56	131.4 Å²	131.4	46%	0.463	61%	0.612	S	S	.	*	H	α-helix	trans	-74.6	-35.5	175.4	0	0	0	0	0	112.1	Q26 E27 E28 K33 R34	Q26-A30 VanDerWaalsContact O-CB 3.32Å; Q26-A30 WeakPolarHBondContact O-CB 3.24Å; Q26-A30 PolarHBondContact O-N 2.84Å; E27-A30 PolarHBondContact O-N 2.95Å; E28-A30 VanDerWaalsContact C-N 3.32Å; E28-A30 PolarHBondContact O-N 3.46Å; A30-K33 PolarHBondContact O-N 3.18Å; A30-R34 PolarHBondContact O-N 3.25Å
31	E	56.1	Low	62.1	Low	133 Å²	133	134.6 Å²	134.6	62%	0.621	62%	0.62	S	S	*	*	H	α-helix	trans	-70.3	-43.1	177.4	-167.3	163	-144.1	0	0	111.3	E27 E28 K33 R34 L35	E27-E31 WeakPolarHBondContact O-CB 3.35Å; E27-E31 PolarHBondContact O-N 3Å; E28-E31 PolarHBondContact O-N 3.45Å; E31-K33 VanDerWaalsContact C-N 3.31Å; E31-K33 PolarHBondContact O-N 2.9Å; E31-R34 PolarHBondContact O-N 3.23Å; E31-R34 VanDerWaalsContact O-N 3.14Å; E31-L35 PolarHBondContact O-N 2.95Å
32	I	59	Low	60.7	Low	86 Å²	86	131.4 Å²	131.4	44%	0.441	61%	0.61	S	S	.	*	H	α-helix	trans	-61.4	-40.1	171.7	-66.6	165.1	0	0	0	111	E28 R34 L35 K36	E28-I32 HydrophobicContact CG-CD1 3.99Å; E28-I32 WeakPolarHBondContact O-CB 3.37Å; E28-I32 WeakPolarHBondContact O-CD1 3.46Å; E28-I32 WeakPolarHBondContact O-CG1 3.49Å; E28-I32 PolarHBondContact O-N 3.09Å; I32-R34 VanDerWaalsContact C-N 3.33Å; I32-L35 PolarHBondContact O-N 3.45Å; I32-K36 HydrophobicContact CG2-CD 4.39Å; I32-K36 WeakPolarHBondContact O-CB 3.5Å; I32-K36 PolarHBondContact O-N 3.14Å
33	K	60.8	Low	59.7	Low	167 Å²	167	128.3 Å²	128.3	73%	0.726	61%	0.611	S	S	*	*	H	α-helix	trans	-68.3	-31.3	176.2	-169.8	176.1	179.8	-179	0	112.3	K29 A30 E31 N37	K29-K33 WeakPolarHBondContact O-CB 3.31Å; K29-K33 PolarHBondContact O-N 3.17Å; K29-K33 VanDerWaalsContact O-N 3.15Å; A30-K33 PolarHBondContact O-N 3.18Å; E31-K33 VanDerWaalsContact C-N 3.31Å; E31-K33 PolarHBondContact O-N 2.9Å; K33-N37 PolarHBondContact O-N 2.74Å
34	R	56.4	Low	58.6	Low	204 Å²	204	129.5 Å²	129.5	77%	0.77	62%	0.621	S	S	*	*	H	α-helix	trans	-71.3	-45.2	172.2	-82.7	-170	127.8	162.9	0.7	112.1	A30 E31 I32 N37 S38	A30-R34 PolarHBondContact O-N 3.25Å; E31-R34 PolarHBondContact O-N 3.23Å; E31-R34 VanDerWaalsContact O-N 3.14Å; I32-R34 VanDerWaalsContact C-N 3.33Å; R34-N37 PolarHBondContact O-N 2.96Å; R34-S38 PolarHBondContact O-N 2.94Å
35	L	57.8	Low	57.5	Low	122 Å²	122	131.5 Å²	131.5	64%	0.639	62%	0.624	S	S	*	*	H	α-helix	trans	-60.1	-48.3	179	-123.2	78.6	0	0	0	111.3	E31 I32 N37 S38 D39	E31-L35 PolarHBondContact O-N 2.95Å; I32-L35 PolarHBondContact O-N 3.45Å; L35-N37 PolarHBondContact O-N 2.81Å; L35-S38 PolarHBondContact O-N 3.13Å; L35-S38 VanDerWaalsContact O-N 3.08Å; L35-D39 PolarHBondContact O-N 3Å
36	K	57.5	Low	56.7	Low	157 Å²	157	132.1 Å²	132.1	68%	0.683	63%	0.632	S	S	*	*	H	α-helix	trans	-64.1	-22.5	178.8	-82.8	179.4	169.3	177.3	0	114.7	I32	I32-K36 HydrophobicContact CG2-CD 4.39Å; I32-K36 WeakPolarHBondContact O-CB 3.5Å; I32-K36 PolarHBondContact O-N 3.14Å
37	N	53.6	Low	56.3	Low	127 Å²	127	131.8 Å²	131.8	68%	0.679	64%	0.642	S	S	*	*	H	α-helix	trans	-88.9	-19.1	176.1	-153.5	-110.7	0	0	0	112.6	K33 R34 L35	K33-N37 PolarHBondContact O-N 2.74Å; R34-N37 PolarHBondContact O-N 2.96Å; L35-N37 PolarHBondContact O-N 2.81Å
38	S	52.8	Low	55.6	Low	67 Å²	67	134.3 Å²	134.3	47%	0.469	66%	0.659	S	S	.	*	H	α-helix	trans	-80.2	-34.9	175.7	-125.2	0	0	0	0	112	R34 L35 D40 R41 D42	R34-S38 PolarHBondContact O-N 2.94Å; L35-S38 PolarHBondContact O-N 3.13Å; L35-S38 VanDerWaalsContact O-N 3.08Å; S38-D40 PolarHBondContact O-N 3.07Å; S38-R41 PolarHBondContact O-N 3.07Å; S38-D42 PolarHBondContact O-N 3.36Å
39	D	52.5	Low	55.3	Low	121 Å²	121	137.6 Å²	137.6	65%	0.647	67%	0.674	S	S	*	*	H	α-helix	trans	-64.9	-37.5	-175.5	-115.4	-14	0	0	0	114.5	L35 R41 S43	L35-D39 PolarHBondContact O-N 3Å; D39-R41 VanDerWaalsContact C-N 3.25Å; D39-R41 PolarHBondContact O-N 3.38Å; D39-S43 PolarHBondContact O-OG 3.18Å; D39-S43 VanDerWaalsContact O-OG 3.08Å
40	D	53.8	Low	54.8	Low	142 Å²	142	139.1 Å²	139.1	76%	0.759	68%	0.684	S	S	*	*	H	α-helix	trans	-74.8	-13.4	178.4	-96.7	-25.2	0	0	0	113.4	S38	S38-D40 PolarHBondContact O-N 3.07Å
41	R	53.2	Low	54.8	Low	210 Å²	210	139.9 Å²	139.9	79%	0.792	70%	0.698	S	S	*	*	H	α-helix	trans	-99.7	-28.5	179.8	-79.4	-77.9	-175.5	148.8	-1.3	112.8	S38 D39	S38-R41 PolarHBondContact O-N 3.07Å; D39-R41 VanDerWaalsContact C-N 3.25Å; D39-R41 PolarHBondContact O-N 3.38Å
42	D	52.2	Low	54.8	Low	75 Å²	75	140.9 Å²	140.9	40%	0.401	70%	0.702	S	S	.	*	H	α-helix	trans	-81.1	-25.9	-178.6	-98.5	-26.1	0	0	0	113.4	S38 K44 R45	S38-D42 PolarHBondContact O-N 3.36Å; D42-K44 PolarHBondContact O-N 2.91Å; D42-R45 WeakPolarHBondContact O-CB 3.38Å; D42-R45 PolarHBondContact O-N 3.38Å
43	S	56.9	Low	54.6	Low	85 Å²	85	145 Å²	145	59%	0.594	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-8.7	-179.1	36.9	0	0	0	0	115.5	D39	D39-S43 PolarHBondContact O-OG 3.18Å; D39-S43 VanDerWaalsContact O-OG 3.08Å
44	K	48.4	Very low	54.6	Low	196 Å²	196	146.9 Å²	146.9	85%	0.852	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	1.9	168.4	-73	-172.4	-179.3	178.1	0	113.8	D42	D42-K44 PolarHBondContact O-N 2.91Å
45	R	51.2	Low	54.9	Low	188 Å²	188	144.3 Å²	144.3	71%	0.709	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-11.8	-177.6	179.1	170	-91	-85.4	-0.5	113	D42	D42-R45 WeakPolarHBondContact O-CB 3.38Å; D42-R45 PolarHBondContact O-N 3.38Å
46	D	52.7	Low	55.2	Low	127 Å²	127	146.2 Å²	146.2	68%	0.679	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	12.7	-173.5	-66.1	-21.3	0	0	0	114.9
47	S	56.3	Low	56	Low	113 Å²	113	149.2 Å²	149.2	79%	0.79	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	15	175	-51	0	0	0	0	114.5
48	L	48.6	Very low	56.9	Low	171 Å²	171	151.2 Å²	151.2	90%	0.895	75%	0.748	S	S	*	*			trans	-125.7	43.7	176.8	-157.4	76.2	0	0	0	111.6
49	E	53.8	Low	58.1	Low	176 Å²	176	156.1 Å²	156.1	82%	0.822	76%	0.764	S	S	*	*			trans	-111	95	166	-176.7	169.3	-162.9	0	0	108
50	E	56.4	Low	59.1	Low	198 Å²	198	156.9 Å²	156.9	93%	0.925	77%	0.766	S	S	*	*			trans	154.1	97.4	147.7	-92	-164.6	136.7	0	0	108.9
51	G	60.3	Low	60.1	Low	73 Å²	73	156.4 Å²	156.4	75%	0.753	77%	0.769	S	S	*	*			trans	-174.1	92.2	178.3	0	0	0	0	0	112.6
52	E	55.6	Low	61.2	Low	153 Å²	153	152.5 Å²	152.5	72%	0.715	76%	0.762	S	S	*	*			trans	68.2	68.2	150.1	-62.2	-174.9	144.2	0	0	119.2
53	L	54.9	Low	62.5	Low	174 Å²	174	159.2 Å²	159.2	91%	0.911	78%	0.782	S	S	*	*			trans	-93.9	50.2	131.3	-83.9	169.6	0	0	0	109.5	D55	L53-D55 PolarHBondContact O-N 2.84Å
54	R	60.9	Low	63.3	Low	205 Å²	205	162.5 Å²	162.5	77%	0.774	79%	0.793	S	S	*	*			trans	-71.9	122	153.5	-90.5	-172.1	171.3	-138.9	-0.7	104.9	H56	R54-H56 PolarHBondContact O-N 3.41Å; R54-H56 PolarHBondContact O-ND1 3.31Å
55	D	63.3	Low	64.4	Low	151 Å²	151	155.5 Å²	155.5	81%	0.807	77%	0.769	S	S	*	*			trans	-45.3	120.6	169.5	-73.1	-38.7	0	0	0	107.7	L53 R57	L53-D55 PolarHBondContact O-N 2.84Å; D55-R57 PolarHBondContact O-N 2.8Å
56	H	64.2	Low	65.1	Low	162 Å²	162	152.8 Å²	152.8	75%	0.75	78%	0.775	S	S	*	*			trans	-70.9	67.1	176.6	-69.5	65.2	0	0	0	108	R54 M58	R54-H56 PolarHBondContact O-N 3.41Å; R54-H56 PolarHBondContact O-ND1 3.31Å; H56-M58 VanDerWaalsContact C-N 3.25Å; H56-M58 PolarHBondContact O-N 2.8Å
57	R	74.6	Confident	65.3	Low	220 Å²	220	156.6 Å²	156.6	83%	0.83	78%	0.781	S	S	*	*			trans	-71.4	92.9	167.3	-176.5	-177.4	-74.3	-94.4	2.5	105.3	D55 E59	D55-R57 PolarHBondContact O-N 2.8Å; R57-E59 PolarHBondContact O-N 3.46Å
58	M	72.6	Confident	65.5	Low	169 Å²	169	160.5 Å²	160.5	83%	0.833	78%	0.779	S	S	*	*			trans	-61.9	101.6	169.7	-68.6	-170.7	-63.6	0	0	107.8	H56	H56-M58 VanDerWaalsContact C-N 3.25Å; H56-M58 PolarHBondContact O-N 2.8Å
59	E	77.3	Confident	66.2	Low	170 Å²	170	163.2 Å²	163.2	79%	0.794	78%	0.777	S	S	*	*			trans	-87.2	108.3	173.3	-170.1	169.3	-158.9	0	0	108.1	R57	R57-E59 PolarHBondContact O-N 3.46Å
60	I	73.7	Confident	66.2	Low	136 Å²	136	161 Å²	161	70%	0.697	77%	0.767	S	S	*	*			trans	-93.6	111.3	173.7	55.1	167.6	0	0	0	109	I62	I60-I62 HydrophobicContact CD1-CD1 4.12Å; I60-I62 HydrophobicContact CD1-CG1 4.44Å; I60-I62 PolarHBondContact O-N 3.19Å
61	T	75.6	Confident	66.3	Low	133 Å²	133	158.8 Å²	158.8	82%	0.816	76%	0.761	S	S	*	*			trans	-81.6	99.6	175.2	-52.6	0	0	0	0	109.4
62	I	76.2	Confident	65.9	Low	127 Å²	127	159.6 Å²	159.6	65%	0.651	76%	0.755	S	S	*	*			trans	-90.2	104.4	172.4	-55.5	-176.5	0	0	0	108.4	I60 N64	I60-I62 HydrophobicContact CD1-CD1 4.12Å; I60-I62 HydrophobicContact CD1-CG1 4.44Å; I60-I62 PolarHBondContact O-N 3.19Å; I62-N64 PolarHBondContact O-N 2.89Å
63	R	80.2	Confident	66	Low	216 Å²	216	161.8 Å²	161.8	82%	0.815	77%	0.768	S	S	*	*			trans	-72.7	111.6	170.7	-179	-174.8	-74.3	-176	-2.5	108.3	S65	R63-S65 VanDerWaalsContact C-N 3.26Å; R63-S65 PolarHBondContact O-N 2.86Å
64	N	72.9	Confident	66	Low	154 Å²	154	161.3 Å²	161.3	82%	0.824	76%	0.761	S	S	*	*			trans	-72.1	84.4	169	-80.4	-22.4	0	0	0	109.6	I62	I62-N64 PolarHBondContact O-N 2.89Å
65	S	70.5	Confident	65.8	Low	50 Å²	50	157.6 Å²	157.6	35%	0.35	76%	0.757	S	S	.	*			trans	-81.5	124	158.2	-66.2	0	0	0	0	107.5	R63 Y67	R63-S65 VanDerWaalsContact C-N 3.26Å; R63-S65 PolarHBondContact O-N 2.86Å; S65-Y67 VanDerWaalsContact C-N 3.3Å; S65-Y67 PolarHBondContact O-N 3.5Å
66	P	67.6	Low	65.5	Low	130 Å²	130	160.9 Å²	160.9	84%	0.844	76%	0.758	S	S	*	*			trans	-75.8	86.3	177.6	31.5	-31.1	0	0	0	108.3	R68	P66-R68 PolarHBondContact O-N 3.43Å
67	Y	56	Low	65.2	Low	207 Å²	207	156.6 Å²	156.6	81%	0.812	76%	0.757	S	S	*	*			trans	-79.5	107.3	171.1	-72.4	-73.3	0	0	0	108.7	S65 R69	S65-Y67 VanDerWaalsContact C-N 3.3Å; S65-Y67 PolarHBondContact O-N 3.5Å; Y67-R69 PolarHBondContact O-N 3.48Å
68	R	61.4	Low	64.3	Low	196 Å²	196	155.5 Å²	155.5	74%	0.74	76%	0.762	S	S	*	*			trans	-57.4	126.3	157.8	-70	179.8	57.4	87.4	4	106.9	P66 E70	P66-R68 PolarHBondContact O-N 3.43Å; R68-E70 VanDerWaalsContact C-N 3.3Å; R68-E70 VanDerWaalsContact CB-OE1 3.3Å; R68-E70 WeakPolarHBondContact CB-OE1 3.49Å; R68-E70 IonicContact CZ-OE1 2.98Å; R68-E70 IonicContact NE-OE1 2.98Å; R68-E70 PolarHBondContact NE-OE1 3.41Å; R68-E70 IonicContact NH2-OE1 3.9Å; R68-E70 PolarHBondContact O-N 2.93Å
69	R	62.4	Low	63.5	Low	228 Å²	228	156 Å²	156	86%	0.86	76%	0.762	S	S	*	*			trans	-74	90.4	170.7	-178.3	-171.7	-63.3	-142.4	-1.1	106.4	Y67	Y67-R69 PolarHBondContact O-N 3.48Å
70	E	53.2	Low	63	Low	130 Å²	130	152.2 Å²	152.2	61%	0.607	75%	0.747	S	S	*	*			trans	-82	126.8	157.9	-79.2	91.6	-146	0	0	108	R68 S72	R68-E70 VanDerWaalsContact C-N 3.3Å; R68-E70 VanDerWaalsContact CB-OE1 3.3Å; R68-E70 WeakPolarHBondContact CB-OE1 3.49Å; R68-E70 IonicContact CZ-OE1 2.98Å; R68-E70 IonicContact NE-OE1 2.98Å; R68-E70 PolarHBondContact NE-OE1 3.41Å; R68-E70 IonicContact NH2-OE1 3.9Å; R68-E70 PolarHBondContact O-N 2.93Å; E70-S72 PolarHBondContact O-N 2.67Å
71	D	60	Low	62.4	Low	150 Å²	150	150.3 Å²	150.3	80%	0.802	74%	0.739	S	S	*	*			trans	-59	118.5	-176.1	-57.5	-58.6	0	0	0	110.9
72	S	52	Low	61.8	Low	90 Å²	90	149 Å²	149	63%	0.629	74%	0.735	S	S	*	*			trans	-114.8	97.5	161.2	-158.9	0	0	0	0	108.8	E70 E74	E70-S72 PolarHBondContact O-N 2.67Å; S72-E74 VanDerWaalsContact C-N 3.31Å; S72-E74 PolarHBondContact O-N 3.32Å; S72-E74 WeakPolarHBondContact OG-CB 3.49Å
73	M	56.4	Low	61	Low	199 Å²	199	149.6 Å²	149.6	98%	0.98	74%	0.738	S	S	*	*			trans	-76.5	88.4	157.3	-74.4	-163.6	-171.1	0	0	107.4
74	E	54.9	Low	60.7	Low	165 Å²	165	141.9 Å²	141.9	77%	0.771	72%	0.721	S	S	*	*			trans	-155.4	130	177.5	-164.1	167.8	-142.1	0	0	106.1	S72	S72-E74 VanDerWaalsContact C-N 3.31Å; S72-E74 PolarHBondContact O-N 3.32Å; S72-E74 WeakPolarHBondContact OG-CB 3.49Å
75	D	57.6	Low	60.4	Low	126 Å²	126	142.6 Å²	142.6	67%	0.674	72%	0.723	S	S	*	*			cis	-160.5	137.7	-16.1	171	32.1	0	0	0	102
76	R	56	Low	60.5	Low	220 Å²	220	146.4 Å²	146.4	83%	0.83	73%	0.733	S	S	*	*			trans	22.5	120.7	169.7	-76.6	177.2	172.5	89.1	-2.9	120.2	E78	R76-E78 PolarHBondContact O-N 3.42Å
77	G	57.9	Low	60.7	Low	72 Å²	72	145.2 Å²	145.2	74%	0.742	73%	0.725	S	S	*	*			trans	-50	128.1	168.1	0	0	0	0	0	115.4
78	E	56.1	Low	61	Low	197 Å²	197	141.2 Å²	141.2	92%	0.921	73%	0.725	S	S	*	*				-107.5	104.9	128.6	-78.3	-171.6	165.6	0	0	106.5	R76 D80	R76-E78 PolarHBondContact O-N 3.42Å; E78-D80 PolarHBondContact O-N 2.93Å; E78-D80 VanDerWaalsContact O-N 3.11Å
79	E	56.5	Low	61.2	Low	179 Å²	179	140.1 Å²	140.1	84%	0.836	73%	0.728	S	S	*	*			trans	-69.3	104.6	177.2	-61.7	-177.9	150.9	0	0	108.3	D81	E79-D81 PolarHBondContact O-N 2.87Å
80	D	65.1	Low	61.4	Low	92 Å²	92	138.5 Å²	138.5	49%	0.492	73%	0.73	S	S	.	*			trans	-69.7	82.8	169.8	-168.3	7.7	0	0	0	109.3	E78 S82 L83	E78-D80 PolarHBondContact O-N 2.93Å; E78-D80 VanDerWaalsContact O-N 3.11Å; D80-S82 PolarHBondContact O-N 3.18Å; D80-S82 WeakPolarHBondContact OD1-CB 3.48Å; D80-S82 PolarHBondContact OD1-N 2.96Å; D80-S82 PolarHBondContact OD1-OG 2.89Å; D80-L83 HydrophobicContact CB-CD1 4.27Å; D80-L83 HydrophobicContact CB-CG 4.41Å; D80-L83 PolarHBondContact O-N 3.05Å; D80-L83 WeakPolarHBondContact OD2-CD1 3.38Å; D80-L83 WeakPolarHBondContact OD2-CG 3.18Å
81	D	62.5	Low	61.9	Low	96 Å²	96	140.6 Å²	140.6	51%	0.513	74%	0.742	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-3.8	178.7	-151.9	47.8	0	0	0	112.6	E79 K86	E79-D81 PolarHBondContact O-N 2.87Å; D81-K86 IonicContact OD2-NZ 3.41Å; D81-K86 PolarHBondContact OD2-NZ 2.77Å
82	S	62	Low	61.8	Low	105 Å²	105	138.1 Å²	138.1	73%	0.734	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-26.3	172.5	-37.7	0	0	0	0	113	D80	D80-S82 PolarHBondContact O-N 3.18Å; D80-S82 WeakPolarHBondContact OD1-CB 3.48Å; D80-S82 PolarHBondContact OD1-N 2.96Å; D80-S82 PolarHBondContact OD1-OG 2.89Å
83	L	59.7	Low	62.3	Low	139 Å²	139	145.9 Å²	145.9	73%	0.728	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-13.6	179	-63	176.8	0	0	0	112.6	D80 I85	D80-L83 HydrophobicContact CB-CD1 4.27Å; D80-L83 HydrophobicContact CB-CG 4.41Å; D80-L83 PolarHBondContact O-N 3.05Å; D80-L83 WeakPolarHBondContact OD2-CD1 3.38Å; D80-L83 WeakPolarHBondContact OD2-CG 3.18Å; L83-I85 PolarHBondContact O-N 3.48Å
84	A	73.7	Confident	62.4	Low	55 Å²	55	144.5 Å²	144.5	46%	0.455	74%	0.741	S	S	.	*	S	Bend	trans	-73.9	113.4	175.5	0	0	0	0	0	110.4	K86	A84-K86 PolarHBondContact O-N 3.44Å
85	I	66.9	Low	62.7	Low	168 Å²	168	145.2 Å²	145.2	86%	0.862	74%	0.744	S	S	*	*			trans	-66.2	97.5	170	-59.3	173.6	0	0	0	107.4	L83 P87	L83-I85 PolarHBondContact O-N 3.48Å; I85-P87 WeakPolarHBondContact O-CD 3.39Å
86	K	72.8	Confident	62.2	Low	131 Å²	131	147.8 Å²	147.8	57%	0.57	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-62	120.9	-179.1	-70.5	178.8	177.6	178.3	0	109	D81 A84	D81-K86 IonicContact OD2-NZ 3.41Å; D81-K86 PolarHBondContact OD2-NZ 2.77Å; A84-K86 PolarHBondContact O-N 3.44Å
87	P	72.7	Confident	62.3	Low	104 Å²	104	141.3 Å²	141.3	68%	0.675	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-60.9	148.4	172.5	25.8	-32.7	0	0	0	109.1	I85 Q89	I85-P87 WeakPolarHBondContact O-CD 3.39Å; P87-Q89 PolarHBondContact O-N 3.42Å
88	P	61.1	Low	62.5	Low	123 Å²	123	146.6 Å²	146.6	80%	0.799	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-54.3	119.9	179.4	22.2	-32.2	0	0	0	108.9	Q90	P88-Q90 PolarHBondContact O-N 2.88Å
89	Q	65.9	Low	62.4	Low	174 Å²	174	143.3 Å²	143.3	81%	0.813	73%	0.732	S	S	*	*			trans	-59.4	103.5	-175.8	-73.4	-163.8	-17.3	0	0	109.5	P87 M91	P87-Q89 PolarHBondContact O-N 3.42Å; Q89-M91 VanDerWaalsContact C-N 3.35Å; Q89-M91 PolarHBondContact O-N 3.13Å
90	Q	66.7	Low	62.5	Low	193 Å²	193	146.5 Å²	146.5	90%	0.902	74%	0.737	S	S	*	*			trans	-64.5	102.5	163.2	-79.2	-168.7	-67.7	0	0	106.8	P88 S92	P88-Q90 PolarHBondContact O-N 2.88Å; Q90-S92 PolarHBondContact O-N 2.84Å
91	M	63.3	Low	62.1	Low	175 Å²	175	151 Å²	151	86%	0.862	75%	0.752	S	S	*	*			trans	-56.4	117.9	177.4	-63.3	-131.2	-62.2	0	0	108.9	Q89 R93	Q89-M91 VanDerWaalsContact C-N 3.35Å; Q89-M91 PolarHBondContact O-N 3.13Å; M91-R93 PolarHBondContact O-N 2.96Å
92	S	58	Low	62	Low	98 Å²	98	150.8 Å²	150.8	69%	0.685	75%	0.751	S	S	*	*			trans	-45	126.1	177.5	59	0	0	0	0	110.7	Q90 K94	Q90-S92 PolarHBondContact O-N 2.84Å; S92-K94 VanDerWaalsContact C-N 3.28Å; S92-K94 PolarHBondContact O-N 3.36Å
93	R	63.2	Low	61.9	Low	253 Å²	253	152.8 Å²	152.8	96%	0.955	75%	0.748	S	S	*	*			trans	-54.8	93.2	163.2	-175.1	-179.6	-173.4	-158.3	1.5	108.3	M91 E95	M91-R93 PolarHBondContact O-N 2.96Å; R93-E95 PolarHBondContact O-N 3.16Å; R93-E95 VanDerWaalsContact O-N 3.17Å
94	K	57.8	Low	62.1	Low	169 Å²	169	153.1 Å²	153.1	74%	0.735	74%	0.744	S	S	*	*			trans	-82.6	95.8	179.7	-167.5	151.3	-175.9	170.7	0	109	S92 K96	S92-K94 VanDerWaalsContact C-N 3.28Å; S92-K94 PolarHBondContact O-N 3.36Å; K94-K96 PolarHBondContact O-N 2.84Å
95	E	61	Low	61.5	Low	180 Å²	180	160.2 Å²	160.2	84%	0.841	76%	0.759	S	S	*	*			trans	-60.9	121.7	153.8	-172.3	176.9	-161.4	0	0	108.1	R93	R93-E95 PolarHBondContact O-N 3.16Å; R93-E95 VanDerWaalsContact O-N 3.17Å
96	K	48	Very low	61.3	Low	181 Å²	181	159.1 Å²	159.1	79%	0.787	75%	0.748	S	S	*	*			trans	-169.8	116.9	150.7	-107.1	161.5	-175.3	-179.3	0	111.4	K94	K94-K96 PolarHBondContact O-N 2.84Å
97	A	57.2	Low	60.6	Low	84 Å²	84	158 Å²	158	69%	0.694	75%	0.745	S	S	*	*			trans	-60.5	154.8	162.1	0	0	0	0	0	111.1
98	H	61.4	Low	60.2	Low	182 Å²	182	160.9 Å²	160.9	84%	0.843	75%	0.746	S	S	*	*			trans	72.9	79.7	171.9	-68.9	-89.1	0	0	0	119
99	H	55.9	Low	60.1	Low	128 Å²	128	165 Å²	165	59%	0.593	75%	0.746	S	S	*	*			trans	-148.6	33	150.3	-126.1	45.3	0	0	0	116.5	K101 D102	H99-K101 VanDerWaalsContact C-N 3.25Å; H99-K101 PolarHBondContact O-N 3.4Å; H99-D102 IonicContact CE1-OD2 3.89Å; H99-D102 PolarHBondContact CE1-OD2 2.88Å; H99-D102 VanDerWaalsContact CE1-OD2 3.28Å; H99-D102 IonicContact NE2-OD2 2.95Å
100	R	56.7	Low	59.9	Low	247 Å²	247	164.8 Å²	164.8	93%	0.932	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-5.1	-175.4	-129	177.3	-171.5	149.1	1.6	115.6
101	K	58.6	Low	59.5	Low	187 Å²	187	161.5 Å²	161.5	81%	0.813	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-32.5	-172.3	-150.7	172.3	-176.8	179.7	0	114.8	H99	H99-K101 VanDerWaalsContact C-N 3.25Å; H99-K101 PolarHBondContact O-N 3.4Å
102	D	59.7	Low	59	Low	91 Å²	91	164.2 Å²	164.2	49%	0.487	72%	0.723	S	S	.	*	H	α-helix	trans	-82.5	-29.6	-177.7	-73.8	-33.7	0	0	0	113.7	H99 K104 R105 K106	H99-D102 IonicContact CE1-OD2 3.89Å; H99-D102 PolarHBondContact CE1-OD2 2.88Å; H99-D102 VanDerWaalsContact CE1-OD2 3.28Å; H99-D102 IonicContact NE2-OD2 2.95Å; D102-K104 VanDerWaalsContact C-N 3.34Å; D102-K104 PolarHBondContact O-N 3.21Å; D102-R105 PolarHBondContact O-N 2.89Å; D102-K106 PolarHBondContact O-N 2.91Å; D102-K106 VanDerWaalsContact O-N 3.14Å
103	E	60.8	Low	58.8	Low	146 Å²	146	163.8 Å²	163.8	68%	0.682	72%	0.72	S	S	*	*	H	α-helix	trans	-63.5	-41.4	179	-146.1	168.4	-153.3	0	0	111.3	R105 K106 E107	E103-R105 VanDerWaalsContact C-N 3.3Å; E103-R105 PolarHBondContact O-N 3.5Å; E103-K106 PolarHBondContact O-N 2.95Å; E103-E107 VanDerWaalsContact O-CB 3.31Å; E103-E107 WeakPolarHBondContact O-CB 3.43Å; E103-E107 PolarHBondContact O-N 3.46Å
104	K	62.8	Low	58.3	Low	147 Å²	147	159 Å²	159	64%	0.639	71%	0.708	S	S	*	*	H	α-helix	trans	-67.7	-26.1	179	-157	163.3	-172.6	170.9	0	113.4	D102 K108	D102-K104 VanDerWaalsContact C-N 3.34Å; D102-K104 PolarHBondContact O-N 3.21Å; K104-K108 PolarHBondContact O-N 2.89Å
105	R	61.3	Low	58	Low	203 Å²	203	156.5 Å²	156.5	77%	0.766	71%	0.712	S	S	*	*	H	α-helix	trans	-81.3	-36.8	175.8	-165	178.1	-176.8	-172.8	1.5	111.8	D102 E103 R109	D102-R105 PolarHBondContact O-N 2.89Å; E103-R105 VanDerWaalsContact C-N 3.3Å; E103-R105 PolarHBondContact O-N 3.5Å; R105-R109 PolarHBondContact O-N 3.36Å
106	K	61.4	Low	57.5	Low	146 Å²	146	152.7 Å²	152.7	64%	0.635	71%	0.712	S	S	*	*	H	α-helix	trans	-69.8	-36.4	172.9	-101.1	179.1	176.5	173.3	0	112.1	D102 E103 R109 R110	D102-K106 PolarHBondContact O-N 2.91Å; D102-K106 VanDerWaalsContact O-N 3.14Å; E103-K106 PolarHBondContact O-N 2.95Å; K106-R109 PolarHBondContact O-N 2.93Å; K106-R110 WeakPolarHBondContact O-CG 3.39Å; K106-R110 PolarHBondContact O-N 3.34Å; K106-R110 VanDerWaalsContact O-N 3.13Å
107	E	59.7	Low	57.6	Low	108 Å²	108	150.2 Å²	150.2	51%	0.505	70%	0.703	S	S	.	*	H	α-helix	trans	-63.4	-48.4	177	-173.4	167.3	-146.4	0	0	111.7	E103 R109 R110 H111	E103-E107 VanDerWaalsContact O-CB 3.31Å; E103-E107 WeakPolarHBondContact O-CB 3.43Å; E103-E107 PolarHBondContact O-N 3.46Å; E107-R109 PolarHBondContact O-N 2.74Å; E107-R110 PolarHBondContact O-N 3.42Å; E107-H111 WeakPolarHBondContact CG-NE2 3.4Å; E107-H111 PolarHBondContact O-CD2 3.13Å; E107-H111 PolarHBondContact O-N 2.8Å; E107-H111 VanDerWaalsContact O-N 3.09Å; E107-H111 IonicContact OE1-NE2 3.3Å
108	K	62.7	Low	57.5	Low	163 Å²	163	150.2 Å²	150.2	71%	0.709	71%	0.711	S	S	*	*	H	α-helix	trans	-59.1	-31.3	174	-78.7	-164.4	174.9	-173.3	0	113.7	K104	K104-K108 PolarHBondContact O-N 2.89Å
109	R	60.8	Low	57.2	Low	210 Å²	210	144.6 Å²	144.6	79%	0.792	70%	0.702	S	S	*	*	H	α-helix	trans	-72.3	-30.4	175.8	-124	173.4	90.8	164.9	5	112.6	R105 K106 E107	R105-R109 PolarHBondContact O-N 3.36Å; K106-R109 PolarHBondContact O-N 2.93Å; E107-R109 PolarHBondContact O-N 2.74Å
110	R	60.7	Low	57.1	Low	169 Å²	169	144.7 Å²	144.7	64%	0.638	70%	0.701	S	S	*	*	H	α-helix	trans	-80.3	-28.7	179	-70.4	174.9	179.4	-131.4	-1.6	113.1	K106 E107 R112 S113	K106-R110 WeakPolarHBondContact O-CG 3.39Å; K106-R110 PolarHBondContact O-N 3.34Å; K106-R110 VanDerWaalsContact O-N 3.13Å; E107-R110 PolarHBondContact O-N 3.42Å; R110-R112 VanDerWaalsContact C-N 3.33Å; R110-R112 PolarHBondContact O-N 2.82Å; R110-S113 PolarHBondContact O-OG 3.36Å
111	H	58.8	Low	56.8	Low	125 Å²	125	141.3 Å²	141.3	58%	0.579	70%	0.695	S	S	*	*	H	α-helix	trans	-73.2	-22.1	175.7	-69.8	-65.5	0	0	0	114	E107	E107-H111 WeakPolarHBondContact CG-NE2 3.4Å; E107-H111 PolarHBondContact O-CD2 3.13Å; E107-H111 PolarHBondContact O-N 2.8Å; E107-H111 VanDerWaalsContact O-N 3.09Å; E107-H111 IonicContact OE1-NE2 3.3Å
112	R	53	Low	56.4	Low	231 Å²	231	136.1 Å²	136.1	87%	0.872	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-20.4	177.5	-167.7	170.4	-86	168.3	-7.6	113.2	R110	R110-R112 VanDerWaalsContact C-N 3.33Å; R110-R112 PolarHBondContact O-N 2.82Å
113	S	52.8	Low	56	Low	89 Å²	89	140.9 Å²	140.9	62%	0.622	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-11.2	-178.3	56.5	0	0	0	0	115	R110	R110-S113 PolarHBondContact O-OG 3.36Å
114	H	53.7	Low	55.6	Low	152 Å²	152	138.6 Å²	138.6	70%	0.704	69%	0.694	S	S	*	*	S	Bend	trans	-100.6	3.7	-179	-95.8	-59.2	0	0	0	115.4
115	S	50.4	Low	55	Low	117 Å²	117	137.9 Å²	137.9	82%	0.818	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	17.2	179.6	-116	0	0	0	0	114.7
116	A	50.8	Low	54.4	Low	101 Å²	101	134.4 Å²	134.4	84%	0.835	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	0.1	173.6	0	0	0	0	0	113.9
117	E	51.3	Low	54.1	Low	129 Å²	129	134.2 Å²	134.2	60%	0.603	68%	0.683	S	S	*	*			trans	-125.5	56.4	179.5	-154.1	179.1	-173.8	0	0	111.5	G119 K120	E117-G119 PolarHBondContact O-N 3.46Å; E117-K120 WeakPolarHBondContact OE1-CE 3.34Å; E117-K120 IonicContact OE1-NZ 3.46Å; E117-K120 PolarHBondContact OE1-NZ 3.41Å
118	G	53.7	Low	53.9	Low	84 Å²	84	135.6 Å²	135.6	87%	0.866	69%	0.69	S	S	*	*			trans	-74.4	117.2	167.8	0	0	0	0	0	110.6
119	G	55.7	Low	53.6	Low	64 Å²	64	135.6 Å²	135.6	66%	0.66	69%	0.685	S	S	*	*	S	Bend	trans	162	-13.6	166.6	0	0	0	0	0	118.6	E117	E117-G119 PolarHBondContact O-N 3.46Å
120	K	53.9	Low	53.2	Low	129 Å²	129	131 Å²	131	56%	0.561	67%	0.673	S	S	*	*	S	Bend	trans	-98.8	-17.4	-167.3	-52.7	-171.5	-171	178.7	0	116	E117 V124	E117-K120 WeakPolarHBondContact OE1-CE 3.34Å; E117-K120 IonicContact OE1-NZ 3.46Å; E117-K120 PolarHBondContact OE1-NZ 3.41Å; K120-V124 WeakPolarHBondContact O-CG2 3.48Å
121	H	50.2	Low	53.6	Low	176 Å²	176	129.3 Å²	129.3	82%	0.815	67%	0.671	S	S	*	*	H	α-helix	trans	-83	-22.6	-172.7	-83.7	69	0	0	0	114.9
122	A	50.3	Low	53.6	Low	79 Å²	79	128 Å²	128	65%	0.653	67%	0.666	S	S	*	*	H	α-helix	trans	-72.8	-41.8	176.3	0	0	0	0	0	112	V124 K125 E126	A122-V124 VanDerWaalsContact C-N 3.33Å; A122-V124 PolarHBondContact O-N 2.61Å; A122-K125 PolarHBondContact O-N 3.32Å; A122-E126 PolarHBondContact O-N 3.43Å
123	R	50.5	Low	54	Low	190 Å²	190	125.9 Å²	125.9	72%	0.717	66%	0.658	S	S	*	*	H	α-helix	trans	-67.6	-27.7	-177.8	-117.4	178.6	172.2	-169.9	-1.2	114.1	K127	R123-K127 WeakPolarHBondContact O-CB 3.38Å; R123-K127 WeakPolarHBondContact O-CG 3.5Å; R123-K127 PolarHBondContact O-N 3.39Å; R123-K127 VanDerWaalsContact O-N 3.17Å
124	V	52.6	Low	54.4	Low	98 Å²	98	130.7 Å²	130.7	59%	0.594	66%	0.662	S	S	*	*	H	α-helix	trans	-76.8	-42.4	179	175.6	0	0	0	0	111	K120 A122 E126 K127 E128	K120-V124 WeakPolarHBondContact O-CG2 3.48Å; A122-V124 VanDerWaalsContact C-N 3.33Å; A122-V124 PolarHBondContact O-N 2.61Å; V124-E126 VanDerWaalsContact C-N 3.32Å; V124-E126 PolarHBondContact O-N 2.91Å; V124-K127 PolarHBondContact O-N 3.35Å; V124-E128 PolarHBondContact O-N 3.02Å
125	K	50.9	Low	55	Low	132 Å²	132	130 Å²	130	57%	0.574	66%	0.657	S	S	*	*	H	α-helix	trans	-70.5	-27.7	179.1	-164.8	159.7	-176.2	167.9	0	113.1	A122 R129	A122-K125 PolarHBondContact O-N 3.32Å; K125-R129 WeakPolarHBondContact O-CG 3.27Å; K125-R129 PolarHBondContact O-N 3.04Å
126	E	48.3	Very low	55.5	Low	130 Å²	130	129.7 Å²	129.7	61%	0.607	64%	0.638	S	S	*	*	H	α-helix	trans	-73.9	-45.9	171.1	-169.3	-179.4	-174.3	0	0	111.9	A122 V124 E128 R129 E130	A122-E126 PolarHBondContact O-N 3.43Å; V124-E126 VanDerWaalsContact C-N 3.32Å; V124-E126 PolarHBondContact O-N 2.91Å; E126-E128 VanDerWaalsContact C-N 3.26Å; E126-E128 PolarHBondContact O-N 3.35Å; E126-R129 PolarHBondContact O-N 3.36Å; E126-E130 WeakPolarHBondContact O-CB 3.29Å; E126-E130 PolarHBondContact O-N 2.99Å
127	K	55.4	Low	56.4	Low	142 Å²	142	130.3 Å²	130.3	62%	0.617	62%	0.624	S	S	*	*	H	α-helix	trans	-58.2	-35.6	174.9	-88.5	-178.7	170.7	-175.2	0	113.2	R123 V124 H131	R123-K127 WeakPolarHBondContact O-CB 3.38Å; R123-K127 WeakPolarHBondContact O-CG 3.5Å; R123-K127 PolarHBondContact O-N 3.39Å; R123-K127 VanDerWaalsContact O-N 3.17Å; V124-K127 PolarHBondContact O-N 3.35Å; K127-H131 WeakPolarHBondContact O-CB 3.29Å; K127-H131 PolarHBondContact O-N 3.29Å
128	E	54.9	Low	56.9	Low	138 Å²	138	133.8 Å²	133.8	65%	0.645	63%	0.631	S	S	*	*	H	α-helix	trans	-69.6	-42.7	178.1	-164.4	-178.1	-179.8	0	0	112	V124 E126 H131 E132	V124-E128 PolarHBondContact O-N 3.02Å; E126-E128 VanDerWaalsContact C-N 3.26Å; E126-E128 PolarHBondContact O-N 3.35Å; E128-H131 PolarHBondContact O-N 3.32Å; E128-E132 WeakPolarHBondContact O-CB 3.44Å; E128-E132 PolarHBondContact O-N 3.1Å
129	R	56.2	Low	57.6	Low	162 Å²	162	134.7 Å²	134.7	61%	0.611	61%	0.613	S	S	*	*	H	α-helix	trans	-68.2	-35.1	175.1	-72.4	175.3	173.4	177.9	-3.7	112.6	K125 E126 R133	K125-R129 WeakPolarHBondContact O-CG 3.27Å; K125-R129 PolarHBondContact O-N 3.04Å; E126-R129 PolarHBondContact O-N 3.36Å; R129-R133 WeakPolarHBondContact O-CG 3.44Å; R129-R133 PolarHBondContact O-N 3.28Å; R129-R133 VanDerWaalsContact O-N 3.16Å
130	E	53.5	Low	58.2	Low	115 Å²	115	137.8 Å²	137.8	54%	0.537	61%	0.61	S	S	.	*	H	α-helix	trans	-68.9	-43.5	174.2	-168.8	-171.1	177.4	0	0	111.4	E126 E132 R133 R134	E126-E130 WeakPolarHBondContact O-CB 3.29Å; E126-E130 PolarHBondContact O-N 2.99Å; E130-E132 VanDerWaalsContact C-N 3.31Å; E130-E132 PolarHBondContact O-N 3.29Å; E130-R133 PolarHBondContact O-N 3.43Å; E130-R134 WeakPolarHBondContact O-CB 3.32Å; E130-R134 PolarHBondContact O-N 3.12Å
131	H	68	Low	58.7	Low	132 Å²	132	137.6 Å²	137.6	61%	0.611	61%	0.611	S	S	*	*	H	α-helix	trans	-62.8	-37	176.6	-171.1	-98.7	0	0	0	112	K127 E128 K135	K127-H131 WeakPolarHBondContact O-CB 3.29Å; K127-H131 PolarHBondContact O-N 3.29Å; E128-H131 PolarHBondContact O-N 3.32Å; H131-K135 VanDerWaalsContact O-CB 3.28Å; H131-K135 WeakPolarHBondContact O-CB 3.35Å; H131-K135 PolarHBondContact O-N 3.21Å
132	E	60.3	Low	59.8	Low	98 Å²	98	133 Å²	133	46%	0.458	59%	0.593	S	S	.	*	H	α-helix	trans	-67.3	-41.3	174.6	-158.9	-157.8	-179.1	0	0	112.5	E128 E130 K135 R136	E128-E132 WeakPolarHBondContact O-CB 3.44Å; E128-E132 PolarHBondContact O-N 3.1Å; E130-E132 VanDerWaalsContact C-N 3.31Å; E130-E132 PolarHBondContact O-N 3.29Å; E132-K135 PolarHBondContact O-N 2.88Å; E132-R136 VanDerWaalsContact CD-CZ 3.44Å; E132-R136 WeakPolarHBondContact O-CG 3.41Å; E132-R136 PolarHBondContact O-N 2.74Å; E132-R136 IonicContact OE1-CZ 2.67Å; E132-R136 IonicContact OE1-NH1 3.74Å; E132-R136 PolarHBondContact OE1-NH1 3.28Å; E132-R136 IonicContact OE1-NH2 2.82Å; E132-R136 IonicContact OE2-CZ 2.83Å; E132-R136 IonicContact OE2-NH1 3.28Å; E132-R136 PolarHBondContact OE2-NH1 3.49Å; E132-R136 IonicContact OE2-NH2 2.58Å; E132-R136 PolarHBondContact OE2-NH2 2.75Å
133	R	61.1	Low	61.3	Low	186 Å²	186	135 Å²	135	70%	0.702	59%	0.587	S	S	*	*	H	α-helix	trans	-64.2	-42.7	174.3	-74.5	179.1	173.1	-144.6	-2.4	112.1	R129 E130 R136 H137	R129-R133 WeakPolarHBondContact O-CG 3.44Å; R129-R133 PolarHBondContact O-N 3.28Å; R129-R133 VanDerWaalsContact O-N 3.16Å; E130-R133 PolarHBondContact O-N 3.43Å; R133-R136 PolarHBondContact O-N 2.91Å; R133-H137 PolarHBondContact O-N 3.23Å
134	R	60.6	Low	62.6	Low	190 Å²	190	128.8 Å²	128.8	72%	0.717	58%	0.576	S	S	*	*	H	α-helix	trans	-69.4	-34.1	179.4	-161.2	172.1	-177.9	-176.7	-0.1	112.3	E130 R138	E130-R134 WeakPolarHBondContact O-CB 3.32Å; E130-R134 PolarHBondContact O-N 3.12Å; R134-R138 PolarHBondContact O-N 2.92Å
135	K	67.3	Low	63.8	Low	138 Å²	138	132.2 Å²	132.2	60%	0.6	58%	0.578	S	S	*	*	H	α-helix	trans	-66.7	-44.9	173.2	-170.4	178.4	178.8	-175.8	0	111.7	H131 E132 H137 R138 E139	H131-K135 VanDerWaalsContact O-CB 3.28Å; H131-K135 WeakPolarHBondContact O-CB 3.35Å; H131-K135 PolarHBondContact O-N 3.21Å; E132-K135 PolarHBondContact O-N 2.88Å; K135-H137 PolarHBondContact O-N 3.01Å; K135-R138 PolarHBondContact O-N 2.95Å; K135-E139 WeakPolarHBondContact O-CB 3.47Å; K135-E139 PolarHBondContact O-N 3.45Å
136	R	60.7	Low	64.9	Low	111 Å²	111	133.1 Å²	133.1	42%	0.419	58%	0.578	S	S	.	*	H	α-helix	trans	-57.2	-44.1	175.8	-79.2	-172.4	-80.7	-107.9	-7.1	112.9	E132 R133 R138 E139 E140	E132-R136 VanDerWaalsContact CD-CZ 3.44Å; E132-R136 WeakPolarHBondContact O-CG 3.41Å; E132-R136 PolarHBondContact O-N 2.74Å; E132-R136 IonicContact OE1-CZ 2.67Å; E132-R136 IonicContact OE1-NH1 3.74Å; E132-R136 PolarHBondContact OE1-NH1 3.28Å; E132-R136 IonicContact OE1-NH2 2.82Å; E132-R136 IonicContact OE2-CZ 2.83Å; E132-R136 IonicContact OE2-NH1 3.28Å; E132-R136 PolarHBondContact OE2-NH1 3.49Å; E132-R136 IonicContact OE2-NH2 2.58Å; E132-R136 PolarHBondContact OE2-NH2 2.75Å; R133-R136 PolarHBondContact O-N 2.91Å; R136-R138 PolarHBondContact O-N 3.47Å; R136-E139 PolarHBondContact O-N 3.24Å; R136-E140 WeakPolarHBondContact O-CB 3.31Å; R136-E140 PolarHBondContact O-N 2.88Å
137	H	69.4	Low	66.6	Low	114 Å²	114	132.7 Å²	132.7	53%	0.528	58%	0.576	S	S	.	*	H	α-helix	trans	-66.2	-34.8	179.4	-177.9	-100.4	0	0	0	113.4	R133 K135 Q141	R133-H137 PolarHBondContact O-N 3.23Å; K135-H137 PolarHBondContact O-N 3.01Å; H137-Q141 PolarHBondContact CE1-NE2 3.42Å; H137-Q141 PolarHBondContact O-N 2.77Å
138	R	62.1	Low	68	Low	201 Å²	201	133.2 Å²	133.2	76%	0.758	57%	0.574	S	S	*	*	H	α-helix	trans	-70.1	-40	175.6	-141.8	176.7	-150.6	176.1	4.1	111.2	R134 K135 R136 Q141 D142	R134-R138 PolarHBondContact O-N 2.92Å; K135-R138 PolarHBondContact O-N 2.95Å; R136-R138 PolarHBondContact O-N 3.47Å; R138-Q141 PolarHBondContact O-N 3.16Å; R138-D142 PolarHBondContact O-N 2.97Å
139	E	68.8	Low	69.4	Low	103 Å²	103	132.2 Å²	132.2	48%	0.481	57%	0.569	S	S	.	*	H	α-helix	trans	-70.8	-31.9	177.9	-161	176	172.2	0	0	112.7	K135 R136 K143	K135-E139 WeakPolarHBondContact O-CB 3.47Å; K135-E139 PolarHBondContact O-N 3.45Å; R136-E139 PolarHBondContact O-N 3.24Å; E139-K143 WeakPolarHBondContact O-CB 3.4Å; E139-K143 WeakPolarHBondContact O-CG 3.3Å; E139-K143 PolarHBondContact O-N 2.82Å
140	E	66.6	Low	70.8	Confident	130 Å²	130	130.6 Å²	130.6	61%	0.607	56%	0.563	S	S	*	*	H	α-helix	trans	-68.5	-40.6	172.1	-85	179.1	157.9	0	0	112.9	R136 K143 A144	R136-E140 WeakPolarHBondContact O-CB 3.31Å; R136-E140 PolarHBondContact O-N 2.88Å; E140-K143 PolarHBondContact O-N 3.08Å; E140-A144 WeakPolarHBondContact O-CB 3.29Å; E140-A144 PolarHBondContact O-N 3.34Å
141	Q	66	Low	72.4	Confident	124 Å²	124	130.7 Å²	130.7	58%	0.579	56%	0.563	S	S	*	*	H	α-helix	trans	-64.1	-42.2	174.7	-80.8	-170.7	49.7	0	0	112.2	H137 R138 A144 R145	H137-Q141 PolarHBondContact CE1-NE2 3.42Å; H137-Q141 PolarHBondContact O-N 2.77Å; R138-Q141 PolarHBondContact O-N 3.16Å; Q141-A144 PolarHBondContact O-N 3.21Å; Q141-R145 PolarHBondContact O-N 3.43Å
142	D	71.8	Confident	73.4	Confident	81 Å²	81	129.8 Å²	129.8	43%	0.433	56%	0.558	S	S	.	*	H	α-helix	trans	-68.7	-33.8	176	-90	-5.5	0	0	0	112.4	R138 R146	R138-D142 PolarHBondContact O-N 2.97Å; D142-R146 WeakPolarHBondContact O-CB 3.32Å; D142-R146 WeakPolarHBondContact O-CG 3.48Å; D142-R146 PolarHBondContact O-N 3.34Å
143	K	82.4	Confident	74.5	Confident	121 Å²	121	135.1 Å²	135.1	53%	0.526	57%	0.574	S	S	.	*	H	α-helix	trans	-64.2	-45.9	171	-90.5	178.8	179.2	173.6	0	111.7	E139 E140 R145 R146 E147	E139-K143 WeakPolarHBondContact O-CB 3.4Å; E139-K143 WeakPolarHBondContact O-CG 3.3Å; E139-K143 PolarHBondContact O-N 2.82Å; E140-K143 PolarHBondContact O-N 3.08Å; K143-R145 VanDerWaalsContact C-N 3.31Å; K143-R145 PolarHBondContact O-N 3.24Å; K143-R146 PolarHBondContact O-N 3.48Å; K143-E147 WeakPolarHBondContact O-CB 3.27Å; K143-E147 PolarHBondContact O-N 3.41Å
144	A	77.8	Confident	75.5	Confident	58 Å²	58	133 Å²	133	48%	0.479	57%	0.566	S	S	.	*	H	α-helix	trans	-60.5	-41.7	178.3	0	0	0	0	0	111.4	E140 Q141 E147 W148	E140-A144 WeakPolarHBondContact O-CB 3.29Å; E140-A144 PolarHBondContact O-N 3.34Å; Q141-A144 PolarHBondContact O-N 3.21Å; A144-E147 PolarHBondContact O-N 2.87Å; A144-W148 VanDerWaalsContact O-CB 3.3Å; A144-W148 WeakPolarHBondContact O-CB 3.31Å; A144-W148 PolarHBondContact O-N 3.05Å
145	R	78	Confident	76.5	Confident	170 Å²	170	129.7 Å²	129.7	64%	0.642	56%	0.558	S	S	*	*	H	α-helix	trans	-63	-45.9	174.8	-173.6	174.9	177.5	-90.7	-3.8	112.3	Q141 K143 W148 E149	Q141-R145 PolarHBondContact O-N 3.43Å; K143-R145 VanDerWaalsContact C-N 3.31Å; K143-R145 PolarHBondContact O-N 3.24Å; R145-W148 PolarHBondContact O-N 3.02Å; R145-E149 PolarHBondContact O-N 3.47Å
146	R	74.3	Confident	77.2	Confident	152 Å²	152	128.5 Å²	128.5	57%	0.574	56%	0.556	S	S	*	*	H	α-helix	trans	-69.3	-36.2	177.9	-74	179.6	-174.3	140.7	1.9	113	D142 K143 R150	D142-R146 WeakPolarHBondContact O-CB 3.32Å; D142-R146 WeakPolarHBondContact O-CG 3.48Å; D142-R146 PolarHBondContact O-N 3.34Å; K143-R146 PolarHBondContact O-N 3.48Å; R146-R150 WeakPolarHBondContact O-CB 3.49Å; R146-R150 PolarHBondContact O-N 3.21Å
147	E	83.9	Confident	78	Confident	120 Å²	120	126.2 Å²	126.2	56%	0.561	56%	0.561	S	S	*	*	H	α-helix	trans	-68.7	-38.1	174.8	-85.5	-161.3	138.8	0	0	111.7	K143 A144 R150 Q151	K143-E147 WeakPolarHBondContact O-CB 3.27Å; K143-E147 PolarHBondContact O-N 3.41Å; A144-E147 PolarHBondContact O-N 2.87Å; E147-R150 CarbonylContact O-C 3.59Å; E147-R150 PolarHBondContact O-N 3.28Å; E147-Q151 VanDerWaalsContact O-CB 3.26Å; E147-Q151 WeakPolarHBondContact O-CB 3.47Å; E147-Q151 PolarHBondContact O-N 3.2Å
148	W	84.8	Confident	78.3	Confident	154 Å²	154	128 Å²	128	58%	0.583	56%	0.563	S	S	*	*	H	α-helix	trans	-60.9	-44.9	174.9	-175.1	87	0	0	0	111.7	A144 R145 Q151 K152	A144-W148 VanDerWaalsContact O-CB 3.3Å; A144-W148 WeakPolarHBondContact O-CB 3.31Å; A144-W148 PolarHBondContact O-N 3.05Å; R145-W148 PolarHBondContact O-N 3.02Å; W148-Q151 PolarHBondContact O-N 3.03Å; W148-K152 HydrophobicContact CH2-CD 3.99Å; W148-K152 HydrophobicContact CZ3-CD 4.11Å; W148-K152 WeakPolarHBondContact O-CB 3.26Å; W148-K152 PolarHBondContact O-N 3.2Å
149	E	84	Confident	78.9	Confident	117 Å²	117	121.9 Å²	121.9	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-63.1	-43.6	173.1	-84.4	-157.8	140.2	0	0	112.6	R145 Q151 K152 R153	R145-E149 PolarHBondContact O-N 3.47Å; E149-Q151 VanDerWaalsContact C-N 3.29Å; E149-Q151 PolarHBondContact O-N 3.41Å; E149-K152 PolarHBondContact O-N 3.41Å; E149-R153 PolarHBondContact O-N 2.87Å
150	R	85.2	Confident	79.1	Confident	128 Å²	128	123.1 Å²	123.1	48%	0.483	55%	0.549	S	S	.	.	H	α-helix	trans	-63.7	-37.4	178	-169.4	-179.2	-72	123	-5	111.3	R146 E147 R154	R146-R150 WeakPolarHBondContact O-CB 3.49Å; R146-R150 PolarHBondContact O-N 3.21Å; E147-R150 CarbonylContact O-C 3.59Å; E147-R150 PolarHBondContact O-N 3.28Å; R150-R154 WeakPolarHBondContact O-CB 3.49Å; R150-R154 VanDerWaalsContact O-CG 3.25Å; R150-R154 WeakPolarHBondContact O-CG 3.48Å; R150-R154 PolarHBondContact O-N 3.14Å
151	Q	86.4	Confident	79.4	Confident	116 Å²	116	120.6 Å²	120.6	54%	0.542	55%	0.545	S	S	.	.	H	α-helix	trans	-66.4	-46.8	175	-175.7	-177.6	-36.1	0	0	110.6	E147 W148 E149 R153 R154 E155	E147-Q151 VanDerWaalsContact O-CB 3.26Å; E147-Q151 WeakPolarHBondContact O-CB 3.47Å; E147-Q151 PolarHBondContact O-N 3.2Å; W148-Q151 PolarHBondContact O-N 3.03Å; E149-Q151 VanDerWaalsContact C-N 3.29Å; E149-Q151 PolarHBondContact O-N 3.41Å; Q151-R153 VanDerWaalsContact C-N 3.3Å; Q151-R153 PolarHBondContact O-N 3.35Å; Q151-R154 CarbonylContact O-C 3.59Å; Q151-R154 WeakPolarHBondContact O-CB 3.37Å; Q151-R154 PolarHBondContact O-N 2.92Å; Q151-R154 VanDerWaalsContact O-N 3.13Å; Q151-E155 WeakPolarHBondContact O-CB 3.22Å; Q151-E155 PolarHBondContact O-N 3Å
152	K	89.8	Confident	79.5	Confident	113 Å²	113	123.4 Å²	123.4	49%	0.491	55%	0.55	S	S	.	*	H	α-helix	trans	-57.2	-43	175.7	-168.5	176.6	-177.8	-178.9	0	111.5	W148 E149 E155 M156	W148-K152 HydrophobicContact CH2-CD 3.99Å; W148-K152 HydrophobicContact CZ3-CD 4.11Å; W148-K152 WeakPolarHBondContact O-CB 3.26Å; W148-K152 PolarHBondContact O-N 3.2Å; E149-K152 PolarHBondContact O-N 3.41Å; K152-E155 PolarHBondContact O-N 3.41Å; K152-M156 WeakPolarHBondContact O-CB 3.42Å; K152-M156 VanDerWaalsContact O-CG 3.22Å; K152-M156 WeakPolarHBondContact O-CG 3.47Å; K152-M156 PolarHBondContact O-N 3.15Å
153	R	83.2	Confident	79.3	Confident	211 Å²	211	126.7 Å²	126.7	80%	0.796	56%	0.557	S	S	*	*	H	α-helix	trans	-64.6	-41.2	175.9	-132.8	176.7	-168.1	-116.7	4.2	112.6	E149 Q151 A157	E149-R153 PolarHBondContact O-N 2.87Å; Q151-R153 VanDerWaalsContact C-N 3.3Å; Q151-R153 PolarHBondContact O-N 3.35Å; R153-A157 WeakPolarHBondContact O-CB 3.25Å; R153-A157 PolarHBondContact O-N 3.28Å
154	R	83.3	Confident	78.3	Confident	142 Å²	142	125.2 Å²	125.2	54%	0.536	55%	0.552	S	S	.	*	H	α-helix	trans	-65.7	-38.3	175	-74.2	168.9	177.5	176.7	-1.6	111.8	R150 Q151 A157 R158	R150-R154 WeakPolarHBondContact O-CB 3.49Å; R150-R154 VanDerWaalsContact O-CG 3.25Å; R150-R154 WeakPolarHBondContact O-CG 3.48Å; R150-R154 PolarHBondContact O-N 3.14Å; Q151-R154 CarbonylContact O-C 3.59Å; Q151-R154 WeakPolarHBondContact O-CB 3.37Å; Q151-R154 PolarHBondContact O-N 2.92Å; Q151-R154 VanDerWaalsContact O-N 3.13Å; R154-A157 PolarHBondContact O-N 2.92Å; R154-R158 VanDerWaalsContact O-CG 3.29Å; R154-R158 WeakPolarHBondContact O-CG 3.23Å; R154-R158 PolarHBondContact O-N 3.37Å
155	E	81	Confident	77.8	Confident	119 Å²	119	125.8 Å²	125.8	56%	0.556	55%	0.552	S	S	*	*	H	α-helix	trans	-68.9	-45	178	-168.5	174.9	-168.1	0	0	111.3	Q151 K152 A157 R158 E159	Q151-E155 WeakPolarHBondContact O-CB 3.22Å; Q151-E155 PolarHBondContact O-N 3Å; K152-E155 PolarHBondContact O-N 3.41Å; E155-A157 VanDerWaalsContact C-N 3.28Å; E155-A157 PolarHBondContact O-N 3.41Å; E155-R158 CarbonylContact O-C 3.59Å; E155-R158 PolarHBondContact O-N 3.44Å; E155-R158 VanDerWaalsContact O-N 3.13Å; E155-E159 WeakPolarHBondContact O-CB 3.48Å; E155-E159 PolarHBondContact O-N 3.35Å
156	M	82.2	Confident	77.3	Confident	114 Å²	114	124.2 Å²	124.2	56%	0.562	55%	0.55	S	S	*	*	H	α-helix	trans	-57.1	-41.5	172	-69.5	-68.6	-72.9	0	0	111.7	K152 E159 H160	K152-M156 WeakPolarHBondContact O-CB 3.42Å; K152-M156 VanDerWaalsContact O-CG 3.22Å; K152-M156 WeakPolarHBondContact O-CG 3.47Å; K152-M156 PolarHBondContact O-N 3.15Å; M156-E159 PolarHBondContact O-N 3.45Å; M156-H160 VanDerWaalsContact O-CB 3.23Å; M156-H160 WeakPolarHBondContact O-CB 3.49Å; M156-H160 PolarHBondContact O-N 3.25Å
157	A	77.1	Confident	76.9	Confident	62 Å²	62	126.3 Å²	126.3	51%	0.512	56%	0.558	S	S	.	*	H	α-helix	trans	-66.1	-40.7	175.8	0	0	0	0	0	112.7	R153 R154 E155 S161	R153-A157 WeakPolarHBondContact O-CB 3.25Å; R153-A157 PolarHBondContact O-N 3.28Å; R154-A157 PolarHBondContact O-N 2.92Å; E155-A157 VanDerWaalsContact C-N 3.28Å; E155-A157 PolarHBondContact O-N 3.41Å; A157-S161 VanDerWaalsContact O-CB 3.3Å; A157-S161 WeakPolarHBondContact O-CB 3.48Å; A157-S161 PolarHBondContact O-N 2.88Å
158	R	75.3	Confident	75.8	Confident	153 Å²	153	129 Å²	129	58%	0.577	56%	0.563	S	S	*	*	H	α-helix	trans	-67.5	-38.8	175.2	-73.3	174.4	-174.2	133.3	-4.2	112	R154 E155 S161 R162	R154-R158 VanDerWaalsContact O-CG 3.29Å; R154-R158 WeakPolarHBondContact O-CG 3.23Å; R154-R158 PolarHBondContact O-N 3.37Å; E155-R158 CarbonylContact O-C 3.59Å; E155-R158 PolarHBondContact O-N 3.44Å; E155-R158 VanDerWaalsContact O-N 3.13Å; R158-S161 PolarHBondContact O-N 3.21Å; R158-R162 WeakPolarHBondContact O-CG 3.35Å; R158-R162 PolarHBondContact O-N 3.17Å
159	E	74.4	Confident	74.8	Confident	71 Å²	71	126 Å²	126	33%	0.332	56%	0.555	S	S	.	*	H	α-helix	trans	-67.1	-45.2	176	-165.5	-161.3	-159.7	0	0	110.8	E155 M156 S161 R162 R163	E155-E159 WeakPolarHBondContact O-CB 3.48Å; E155-E159 PolarHBondContact O-N 3.35Å; M156-E159 PolarHBondContact O-N 3.45Å; E159-S161 VanDerWaalsContact C-N 3.29Å; E159-S161 PolarHBondContact O-N 2.9Å; E159-R162 PolarHBondContact O-N 3.05Å; E159-R162 VanDerWaalsContact O-N 3.16Å; E159-R163 VanDerWaalsContact CD-NH2 3.28Å; E159-R163 WeakPolarHBondContact O-CG 3.46Å; E159-R163 PolarHBondContact O-N 3.02Å; E159-R163 IonicContact OE1-CZ 3.66Å; E159-R163 IonicContact OE1-NE 3.97Å; E159-R163 IonicContact OE1-NH1 2.77Å; E159-R163 PolarHBondContact OE1-NH1 3.22Å; E159-R163 IonicContact OE1-NH2 3.65Å; E159-R163 PolarHBondContact OE1-NH2 3.29Å; E159-R163 IonicContact OE2-CZ 2.74Å; E159-R163 VanDerWaalsContact OE2-CZ 3.3Å; E159-R163 IonicContact OE2-NH1 3.56Å; E159-R163 PolarHBondContact OE2-NH1 3.41Å; E159-R163 IonicContact OE2-NH2 3.34Å; E159-R163 PolarHBondContact OE2-NH2 2.92Å
160	H	74.6	Confident	73.6	Confident	130 Å²	130	125.8 Å²	125.8	60%	0.602	56%	0.558	S	S	*	*	H	α-helix	trans	-57.9	-44.2	174	-166.7	-85.9	0	0	0	110.7	M156 R163 E164	M156-H160 VanDerWaalsContact O-CB 3.23Å; M156-H160 WeakPolarHBondContact O-CB 3.49Å; M156-H160 PolarHBondContact O-N 3.25Å; H160-R163 PolarHBondContact O-N 2.94Å; H160-E164 WeakPolarHBondContact O-CB 3.35Å; H160-E164 PolarHBondContact O-N 3.47Å
161	S	71.6	Confident	72.4	Confident	76 Å²	76	122.4 Å²	122.4	53%	0.531	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-40.4	174.8	-178.4	0	0	0	0	113.2	A157 R158 E159 S165	A157-S161 VanDerWaalsContact O-CB 3.3Å; A157-S161 WeakPolarHBondContact O-CB 3.48Å; A157-S161 PolarHBondContact O-N 2.88Å; R158-S161 PolarHBondContact O-N 3.21Å; E159-S161 VanDerWaalsContact C-N 3.29Å; E159-S161 PolarHBondContact O-N 2.9Å; S161-S165 VanDerWaalsContact O-CB 3.27Å; S161-S165 WeakPolarHBondContact O-CB 3.32Å; S161-S165 PolarHBondContact O-N 3.45Å
162	R	69.3	Low	71.1	Confident	184 Å²	184	126.8 Å²	126.8	69%	0.694	57%	0.574	S	S	*	*	H	α-helix	trans	-66.4	-41.5	174.7	-76.8	175.9	179.2	-179.6	0.1	112.3	R158 E159 S165 K166	R158-R162 WeakPolarHBondContact O-CG 3.35Å; R158-R162 PolarHBondContact O-N 3.17Å; E159-R162 PolarHBondContact O-N 3.05Å; E159-R162 VanDerWaalsContact O-N 3.16Å; R162-S165 PolarHBondContact O-N 3.43Å; R162-K166 WeakPolarHBondContact O-CB 3.3Å; R162-K166 WeakPolarHBondContact O-CG 3.46Å; R162-K166 PolarHBondContact O-N 2.91Å
163	R	66.1	Low	69.4	Low	149 Å²	149	127 Å²	127	56%	0.562	58%	0.575	S	S	*	*	H	α-helix	trans	-65.4	-43.8	176.3	-75.4	180	178.2	145.7	-3.9	111	E159 H160 K166 R167	E159-R163 VanDerWaalsContact CD-NH2 3.28Å; E159-R163 WeakPolarHBondContact O-CG 3.46Å; E159-R163 PolarHBondContact O-N 3.02Å; E159-R163 IonicContact OE1-CZ 3.66Å; E159-R163 IonicContact OE1-NE 3.97Å; E159-R163 IonicContact OE1-NH1 2.77Å; E159-R163 PolarHBondContact OE1-NH1 3.22Å; E159-R163 IonicContact OE1-NH2 3.65Å; E159-R163 PolarHBondContact OE1-NH2 3.29Å; E159-R163 IonicContact OE2-CZ 2.74Å; E159-R163 VanDerWaalsContact OE2-CZ 3.3Å; E159-R163 IonicContact OE2-NH1 3.56Å; E159-R163 PolarHBondContact OE2-NH1 3.41Å; E159-R163 IonicContact OE2-NH2 3.34Å; E159-R163 PolarHBondContact OE2-NH2 2.92Å; H160-R163 PolarHBondContact O-N 2.94Å; R163-K166 PolarHBondContact O-N 3.22Å; R163-R167 VanDerWaalsContact O-CB 3.27Å; R163-R167 WeakPolarHBondContact O-CB 3.32Å; R163-R167 PolarHBondContact O-N 3.46Å
164	E	62.9	Low	68	Low	90 Å²	90	117.6 Å²	117.6	42%	0.421	54%	0.544	S	S	.	.	H	α-helix	trans	-57.6	-47.6	171	-105.3	-98.8	125.7	0	0	111.5	H160 K166 R167 R168	H160-E164 WeakPolarHBondContact O-CB 3.35Å; H160-E164 PolarHBondContact O-N 3.47Å; E164-K166 PolarHBondContact O-N 3.25Å; E164-R167 PolarHBondContact O-N 3.08Å; E164-R168 WeakPolarHBondContact O-CB 3.43Å; E164-R168 VanDerWaalsContact O-CG 3.29Å; E164-R168 WeakPolarHBondContact O-CG 3.36Å; E164-R168 PolarHBondContact O-N 3.21Å
165	S	66.1	Low	66.8	Low	70 Å²	70	115 Å²	115	49%	0.49	55%	0.546	S	S	.	.	H	α-helix	trans	-61.9	-45.2	178.8	-179.1	0	0	0	0	112.1	S161 R162 R167 R168 E169	S161-S165 VanDerWaalsContact O-CB 3.27Å; S161-S165 WeakPolarHBondContact O-CB 3.32Å; S161-S165 PolarHBondContact O-N 3.45Å; R162-S165 PolarHBondContact O-N 3.43Å; S165-R167 VanDerWaalsContact C-N 3.33Å; S165-R167 PolarHBondContact O-N 3.18Å; S165-R168 PolarHBondContact O-N 3.5Å; S165-E169 WeakPolarHBondContact O-CB 3.46Å; S165-E169 PolarHBondContact O-N 3.38Å
166	K	68.6	Low	65.6	Low	138 Å²	138	112.6 Å²	112.6	60%	0.6	55%	0.546	S	S	*	.	H	α-helix	trans	-63.3	-37.9	173.7	-73.8	179.1	178.9	-177.8	0	112.3	R162 R163 E164 E169 N170	R162-K166 WeakPolarHBondContact O-CB 3.3Å; R162-K166 WeakPolarHBondContact O-CG 3.46Å; R162-K166 PolarHBondContact O-N 2.91Å; R163-K166 PolarHBondContact O-N 3.22Å; E164-K166 PolarHBondContact O-N 3.25Å; K166-E169 PolarHBondContact O-N 3.44Å; K166-N170 VanDerWaalsContact O-CB 3.29Å; K166-N170 WeakPolarHBondContact O-CB 3.29Å; K166-N170 PolarHBondContact O-N 3.06Å; K166-N170 PolarHBondContact O-ND2 3.17Å
167	R	64.6	Low	64.4	Low	195 Å²	195	111.2 Å²	111.2	74%	0.736	54%	0.544	S	S	*	.	H	α-helix	trans	-68.7	-38.8	177.2	-161.1	171.6	-179.9	-95.6	-0.7	111.4	R163 E164 S165 G171	R163-R167 VanDerWaalsContact O-CB 3.27Å; R163-R167 WeakPolarHBondContact O-CB 3.32Å; R163-R167 PolarHBondContact O-N 3.46Å; E164-R167 PolarHBondContact O-N 3.08Å; S165-R167 VanDerWaalsContact C-N 3.33Å; S165-R167 PolarHBondContact O-N 3.18Å; R167-G171 PolarHBondContact O-N 3.22Å
168	R	61.9	Low	63.5	Low	176 Å²	176	115.9 Å²	115.9	66%	0.664	55%	0.548	S	S	*	.	H	α-helix	trans	-68.6	-37.6	172.2	-69	-179.9	89.6	-174.3	7.1	112.2	E164 S165 G171 R172	E164-R168 WeakPolarHBondContact O-CB 3.43Å; E164-R168 VanDerWaalsContact O-CG 3.29Å; E164-R168 WeakPolarHBondContact O-CG 3.36Å; E164-R168 PolarHBondContact O-N 3.21Å; S165-R168 PolarHBondContact O-N 3.5Å; R168-G171 PolarHBondContact O-N 3.36Å; R168-R172 WeakPolarHBondContact O-CB 3.38Å; R168-R172 WeakPolarHBondContact O-CG 3.48Å; R168-R172 PolarHBondContact O-N 3.06Å
169	E	63.1	Low	62.7	Low	92 Å²	92	113.9 Å²	113.9	43%	0.43	55%	0.548	S	S	.	.	H	α-helix	trans	-67.1	-45.3	175	-167	-166.9	156.6	0	0	111.5	S165 K166 G171 R172 K173	S165-E169 WeakPolarHBondContact O-CB 3.46Å; S165-E169 PolarHBondContact O-N 3.38Å; K166-E169 PolarHBondContact O-N 3.44Å; E169-G171 VanDerWaalsContact C-N 3.31Å; E169-G171 PolarHBondContact O-N 3.17Å; E169-R172 PolarHBondContact O-N 3.41Å; E169-K173 PolarHBondContact O-N 3.08Å; E169-K173 IonicContact OE1-NZ 3.75Å; E169-K173 PolarHBondContact OE1-NZ 2.9Å
170	N	59.8	Low	62.1	Low	113 Å²	113	114.5 Å²	114.5	60%	0.604	56%	0.557	S	S	*	*	H	α-helix	trans	-65.6	-33.9	175.7	-72.5	-17.6	0	0	0	112.2	K166 K173	K166-N170 VanDerWaalsContact O-CB 3.29Å; K166-N170 WeakPolarHBondContact O-CB 3.29Å; K166-N170 PolarHBondContact O-N 3.06Å; K166-N170 PolarHBondContact O-ND2 3.17Å; N170-K173 CarbonylContact O-C 3.43Å; N170-K173 PolarHBondContact O-N 3.06Å
171	G	59.8	Low	61.5	Low	56 Å²	56	109.8 Å²	109.8	58%	0.577	54%	0.544	S	S	*	.	H	α-helix	trans	-69.7	-34.8	171.5	0	0	0	0	0	113.4	R167 R168 E169 G174	R167-G171 PolarHBondContact O-N 3.22Å; R168-G171 PolarHBondContact O-N 3.36Å; E169-G171 VanDerWaalsContact C-N 3.31Å; E169-G171 PolarHBondContact O-N 3.17Å; G171-G174 PolarHBondContact O-N 3.46Å
172	R	57.9	Low	61.3	Low	209 Å²	209	111.4 Å²	111.4	79%	0.789	54%	0.543	S	S	*	.	H	α-helix	trans	-68.3	-32.1	172.1	-82.3	179.8	166.7	-161.9	-4.3	112.5	R168 E169 G174 V177	R168-R172 WeakPolarHBondContact O-CB 3.38Å; R168-R172 WeakPolarHBondContact O-CG 3.48Å; R168-R172 PolarHBondContact O-N 3.06Å; E169-R172 PolarHBondContact O-N 3.41Å; R172-G174 PolarHBondContact O-N 3.17Å; R172-V177 WeakPolarHBondContact O-CG2 3.45Å
173	K	54.2	Low	60.9	Low	116 Å²	116	108.6 Å²	108.6	50%	0.504	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	35.7	168.8	-67.2	173.9	174.8	160.9	0	112.1	E169 N170	E169-K173 PolarHBondContact O-N 3.08Å; E169-K173 IonicContact OE1-NZ 3.75Å; E169-K173 PolarHBondContact OE1-NZ 2.9Å; N170-K173 CarbonylContact O-C 3.43Å; N170-K173 PolarHBondContact O-N 3.06Å
174	G	55.1	Low	60.6	Low	14 Å²	14	109.4 Å²	109.4	14%	0.144	54%	0.541	C	S	.	.			trans	-62.9	167.1	178.4	0	0	0	0	0	113.2	G171 R172 A176 V177	G171-G174 PolarHBondContact O-N 3.46Å; R172-G174 PolarHBondContact O-N 3.17Å; G174-A176 PolarHBondContact O-N 3.49Å; G174-V177 PolarHBondContact O-N 3.09Å
175	P	57.8	Low	60.7	Low	88 Å²	88	110.6 Å²	110.6	57%	0.571	55%	0.547	S	S	*	.	H	α-helix	trans	-53.8	-28.8	-174.8	22.2	-32.9	0	0	0	113.4	V177 R178 L179	P175-V177 PolarHBondContact O-N 3.33Å; P175-R178 PolarHBondContact O-N 3.01Å; P175-L179 WeakPolarHBondContact O-CB 3.47Å; P175-L179 WeakPolarHBondContact O-CD1 3.33Å; P175-L179 WeakPolarHBondContact O-CG 3.35Å; P175-L179 PolarHBondContact O-N 3.13Å
176	A	55.2	Low	60.5	Low	68 Å²	68	115.4 Å²	115.4	56%	0.562	55%	0.554	S	S	*	*	H	α-helix	trans	-59.6	-41.3	175.5	0	0	0	0	0	113.8	G174 L179 T180	G174-A176 PolarHBondContact O-N 3.49Å; A176-L179 PolarHBondContact O-N 3.19Å; A176-T180 WeakPolarHBondContact O-CG2 3.48Å; A176-T180 PolarHBondContact O-N 3.25Å; A176-T180 VanDerWaalsContact O-N 3.09Å; A176-T180 PolarHBondContact O-OG1 3.26Å
177	V	58.1	Low	60.2	Low	86 Å²	86	114.4 Å²	114.4	52%	0.521	55%	0.551	S	S	.	*	H	α-helix	trans	-74.5	-29.2	179	-177.3	0	0	0	0	111.5	R172 G174 P175 T180 G181	R172-V177 WeakPolarHBondContact O-CG2 3.45Å; G174-V177 PolarHBondContact O-N 3.09Å; P175-V177 PolarHBondContact O-N 3.33Å; V177-T180 WeakPolarHBondContact CA-OG1 3.21Å; V177-T180 PolarHBondContact O-OG1 3.41Å; V177-G181 PolarHBondContact O-N 3.32Å
178	R	58.1	Low	60.2	Low	159 Å²	159	109.9 Å²	109.9	60%	0.6	54%	0.539	S	S	*	.	H	α-helix	trans	-75.3	-35.9	174.7	-70.1	-172.7	-73.7	-139.3	-2.1	112.1	P175 H182	P175-R178 PolarHBondContact O-N 3.01Å; R178-H182 PolarHBondContact O-N 3.28Å; R178-H182 VanDerWaalsContact O-N 3.08Å; R178-H182 PolarHBondContact O-ND1 3.44Å
179	L	58.1	Low	60.5	Low	111 Å²	111	106.3 Å²	106.3	58%	0.581	53%	0.533	S	S	*	.	H	α-helix	trans	-66.9	-44.2	175.6	-74.1	166.2	0	0	0	111.3	P175 A176 G181 H182 Q183	P175-L179 WeakPolarHBondContact O-CB 3.47Å; P175-L179 WeakPolarHBondContact O-CD1 3.33Å; P175-L179 WeakPolarHBondContact O-CG 3.35Å; P175-L179 PolarHBondContact O-N 3.13Å; A176-L179 PolarHBondContact O-N 3.19Å; L179-G181 VanDerWaalsContact C-N 3.33Å; L179-G181 PolarHBondContact O-N 3.14Å; L179-H182 PolarHBondContact O-N 3.28Å; L179-Q183 WeakPolarHBondContact O-CB 3.44Å; L179-Q183 PolarHBondContact O-N 2.8Å
180	T	60.8	Low	60.4	Low	84 Å²	84	108 Å²	108	52%	0.515	54%	0.541	S	S	.	.	H	α-helix	trans	-64.5	-36.9	175.9	54.9	0	0	0	0	112.3	A176 V177 Q183 R184	A176-T180 WeakPolarHBondContact O-CG2 3.48Å; A176-T180 PolarHBondContact O-N 3.25Å; A176-T180 VanDerWaalsContact O-N 3.09Å; A176-T180 PolarHBondContact O-OG1 3.26Å; V177-T180 WeakPolarHBondContact CA-OG1 3.21Å; V177-T180 PolarHBondContact O-OG1 3.41Å; T180-Q183 PolarHBondContact O-N 3.28Å; T180-R184 WeakPolarHBondContact O-CB 3.42Å; T180-R184 PolarHBondContact O-N 2.96Å
181	G	63.1	Low	60.4	Low	32 Å²	32	107.8 Å²	107.8	33%	0.33	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-42.6	172.4	0	0	0	0	0	113.4	V177 L179 R184 Q185	V177-G181 PolarHBondContact O-N 3.32Å; L179-G181 VanDerWaalsContact C-N 3.33Å; L179-G181 PolarHBondContact O-N 3.14Å; G181-R184 PolarHBondContact O-N 2.89Å; G181-Q185 WeakPolarHBondContact O-CB 3.42Å; G181-Q185 PolarHBondContact O-N 3.06Å
182	H	67.6	Low	60.4	Low	110 Å²	110	106.6 Å²	106.6	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-69.8	-35.7	176.6	-80	71.5	0	0	0	112.7	R178 L179 R186	R178-H182 PolarHBondContact O-N 3.28Å; R178-H182 VanDerWaalsContact O-N 3.08Å; R178-H182 PolarHBondContact O-ND1 3.44Å; L179-H182 PolarHBondContact O-N 3.28Å; H182-R186 VanDerWaalsContact O-CG 3.31Å; H182-R186 WeakPolarHBondContact O-CG 3.41Å; H182-R186 PolarHBondContact O-N 2.85Å
183	Q	60	Low	60.4	Low	125 Å²	125	105.7 Å²	105.7	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-67.2	-42.9	174.8	-121	155.1	3	0	0	110.9	L179 T180 R186 E187	L179-Q183 WeakPolarHBondContact O-CB 3.44Å; L179-Q183 PolarHBondContact O-N 2.8Å; T180-Q183 PolarHBondContact O-N 3.28Å; Q183-R186 PolarHBondContact O-N 2.58Å; Q183-E187 WeakPolarHBondContact O-CG 3.28Å; Q183-E187 PolarHBondContact O-N 3.3Å
184	R	60	Low	60.6	Low	165 Å²	165	104.7 Å²	104.7	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-65.2	-40	176.1	-147.9	-178.2	90.3	-173.6	5	112.6	T180 G181 E187 E188	T180-R184 WeakPolarHBondContact O-CB 3.42Å; T180-R184 PolarHBondContact O-N 2.96Å; G181-R184 PolarHBondContact O-N 2.89Å; R184-E187 PolarHBondContact O-N 3.03Å; R184-E188 IonicContact CZ-OE1 3.58Å; R184-E188 IonicContact NE-OE1 3.47Å; R184-E188 PolarHBondContact NE-OE1 2.7Å; R184-E188 VanDerWaalsContact NE-OE1 3.11Å; R184-E188 IonicContact NH2-OE1 2.61Å; R184-E188 PolarHBondContact NH2-OE1 2.94Å; R184-E188 WeakPolarHBondContact O-CB 3.49Å; R184-E188 WeakPolarHBondContact O-CG 3.48Å; R184-E188 PolarHBondContact O-N 3.02Å
185	Q	64.1	Low	60.6	Low	116 Å²	116	109.7 Å²	109.7	54%	0.542	55%	0.55	S	S	.	.	H	α-helix	trans	-63.4	-38.7	172.1	-89.2	175.2	-35.8	0	0	112.6	G181 E188 D189	G181-Q185 WeakPolarHBondContact O-CB 3.42Å; G181-Q185 PolarHBondContact O-N 3.06Å; Q185-E188 PolarHBondContact O-N 2.95Å; Q185-D189 VanDerWaalsContact O-CB 3.31Å; Q185-D189 WeakPolarHBondContact O-CB 3.38Å; Q185-D189 VanDerWaalsContact O-CG 3.31Å; Q185-D189 PolarHBondContact O-N 2.95Å
186	R	62.3	Low	60.5	Low	171 Å²	171	110.5 Å²	110.5	65%	0.645	55%	0.553	S	S	*	*	H	α-helix	trans	-66.9	-35.4	174	-74.7	177.2	-166.7	-119.9	4.2	112.6	H182 Q183 Q190	H182-R186 VanDerWaalsContact O-CG 3.31Å; H182-R186 WeakPolarHBondContact O-CG 3.41Å; H182-R186 PolarHBondContact O-N 2.85Å; Q183-R186 PolarHBondContact O-N 2.58Å; R186-Q190 WeakPolarHBondContact O-CB 3.37Å; R186-Q190 VanDerWaalsContact O-CG 3.26Å; R186-Q190 WeakPolarHBondContact O-CG 3.31Å; R186-Q190 PolarHBondContact O-N 2.88Å
187	E	63.6	Low	60.4	Low	116 Å²	116	110.6 Å²	110.6	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-69.8	-42.8	174.1	-73.7	177.8	177	0	0	111.4	Q183 R184 Q190 L191	Q183-E187 WeakPolarHBondContact O-CG 3.28Å; Q183-E187 PolarHBondContact O-N 3.3Å; R184-E187 PolarHBondContact O-N 3.03Å; E187-Q190 PolarHBondContact O-N 3.3Å; E187-L191 WeakPolarHBondContact O-CB 3Å; E187-L191 VanDerWaalsContact O-CG 3.27Å; E187-L191 WeakPolarHBondContact O-CG 3.19Å; E187-L191 PolarHBondContact O-N 3.23Å
188	E	63.9	Low	60	Low	101 Å²	101	108.5 Å²	108.5	47%	0.472	55%	0.545	S	S	.	.	H	α-helix	trans	-64.2	-39.6	174.8	-73.1	178	-159	0	0	111.8	R184 Q185 L191 G192	R184-E188 IonicContact CZ-OE1 3.58Å; R184-E188 IonicContact NE-OE1 3.47Å; R184-E188 PolarHBondContact NE-OE1 2.7Å; R184-E188 VanDerWaalsContact NE-OE1 3.11Å; R184-E188 IonicContact NH2-OE1 2.61Å; R184-E188 PolarHBondContact NH2-OE1 2.94Å; R184-E188 WeakPolarHBondContact O-CB 3.49Å; R184-E188 WeakPolarHBondContact O-CG 3.48Å; R184-E188 PolarHBondContact O-N 3.02Å; Q185-E188 PolarHBondContact O-N 2.95Å; E188-L191 PolarHBondContact O-N 3.4Å; E188-G192 PolarHBondContact O-N 2.83Å
189	D	67.3	Low	59.7	Low	101 Å²	101	107.2 Å²	107.2	54%	0.54	55%	0.549	S	S	.	.	H	α-helix	trans	-67.7	-35.5	174.1	-79.9	-15.4	0	0	0	112.4	Q185 R193	Q185-D189 VanDerWaalsContact O-CB 3.31Å; Q185-D189 WeakPolarHBondContact O-CB 3.38Å; Q185-D189 VanDerWaalsContact O-CG 3.31Å; Q185-D189 PolarHBondContact O-N 2.95Å; D189-R193 WeakPolarHBondContact O-CB 3.38Å; D189-R193 WeakPolarHBondContact O-CG 3.42Å; D189-R193 PolarHBondContact O-N 3Å
190	Q	61.6	Low	59.1	Low	127 Å²	127	112.7 Å²	112.7	59%	0.593	56%	0.562	S	S	*	*	H	α-helix	trans	-69.8	-43.6	173.9	-79.2	-172.6	94.6	0	0	111.5	R186 E187 G192 R193 V194	R186-Q190 WeakPolarHBondContact O-CB 3.37Å; R186-Q190 VanDerWaalsContact O-CG 3.26Å; R186-Q190 WeakPolarHBondContact O-CG 3.31Å; R186-Q190 PolarHBondContact O-N 2.88Å; E187-Q190 PolarHBondContact O-N 3.3Å; Q190-G192 VanDerWaalsContact C-N 3.35Å; Q190-R193 PolarHBondContact O-N 2.9Å; Q190-V194 VanDerWaalsContact O-CG2 3.24Å; Q190-V194 WeakPolarHBondContact O-CG2 3.36Å; Q190-V194 PolarHBondContact O-N 3.29Å
191	L	60.3	Low	58.5	Low	109 Å²	109	116 Å²	116	57%	0.571	58%	0.575	S	S	*	*	H	α-helix	trans	-65.7	-37.8	175	-69.4	172.2	0	0	0	111.7	E187 E188 V194 L195	E187-L191 WeakPolarHBondContact O-CB 3Å; E187-L191 VanDerWaalsContact O-CG 3.27Å; E187-L191 WeakPolarHBondContact O-CG 3.19Å; E187-L191 PolarHBondContact O-N 3.23Å; E188-L191 PolarHBondContact O-N 3.4Å; L191-V194 PolarHBondContact O-N 2.96Å; L191-L195 WeakPolarHBondContact O-CB 3.11Å; L191-L195 WeakPolarHBondContact O-CG 3.42Å; L191-L195 PolarHBondContact O-N 2.78Å
192	G	58.8	Low	57.9	Low	31 Å²	31	124.8 Å²	124.8	32%	0.32	60%	0.598	S	S	.	*	H	α-helix	trans	-63	-40.9	173.1	0	0	0	0	0	112.5	E188 Q190 V196	E188-G192 PolarHBondContact O-N 2.83Å; Q190-G192 VanDerWaalsContact C-N 3.35Å; G192-V196 WeakPolarHBondContact O-CB 3.41Å; G192-V196 WeakPolarHBondContact O-CG2 3.48Å; G192-V196 PolarHBondContact O-N 2.9Å
193	R	58.8	Low	56.8	Low	189 Å²	189	132.9 Å²	132.9	71%	0.713	63%	0.633	S	S	*	*	H	α-helix	trans	-68.1	-37	174	-73.6	171.2	-169.4	-122.7	2.8	112.9	D189 Q190 V196 S197	D189-R193 WeakPolarHBondContact O-CB 3.38Å; D189-R193 WeakPolarHBondContact O-CG 3.42Å; D189-R193 PolarHBondContact O-N 3Å; Q190-R193 PolarHBondContact O-N 2.9Å; R193-V196 PolarHBondContact O-N 3.35Å; R193-S197 PolarHBondContact O-N 3.05Å
194	V	57.4	Low	56.6	Low	96 Å²	96	133.3 Å²	133.3	58%	0.582	64%	0.635	S	S	*	*	H	α-helix	trans	-70.3	-37	176.5	172.8	0	0	0	0	111.4	Q190 L191 S197 G198	Q190-V194 VanDerWaalsContact O-CG2 3.24Å; Q190-V194 WeakPolarHBondContact O-CG2 3.36Å; Q190-V194 PolarHBondContact O-N 3.29Å; L191-V194 PolarHBondContact O-N 2.96Å; V194-S197 PolarHBondContact O-N 3.26Å; V194-S197 PolarHBondContact O-OG 3.45Å; V194-G198 PolarHBondContact O-N 3.27Å
195	L	55.2	Low	56.4	Low	119 Å²	119	131.6 Å²	131.6	62%	0.623	64%	0.636	S	S	*	*	H	α-helix	trans	-67.4	-40.1	173.4	-78.2	163.1	0	0	0	112	L191 G198 I199	L191-L195 WeakPolarHBondContact O-CB 3.11Å; L191-L195 WeakPolarHBondContact O-CG 3.42Å; L191-L195 PolarHBondContact O-N 2.78Å; L195-G198 PolarHBondContact O-N 3.11Å; L195-I199 WeakPolarHBondContact O-CD1 3.49Å; L195-I199 VanDerWaalsContact O-CG1 3.27Å; L195-I199 WeakPolarHBondContact O-CG1 3.3Å; L195-I199 PolarHBondContact O-N 3.3Å; L195-I199 VanDerWaalsContact O-N 3.16Å
196	V	55.5	Low	56	Low	105 Å²	105	132.5 Å²	132.5	64%	0.636	64%	0.641	S	S	*	*	H	α-helix	trans	-70.7	-31.6	176.9	174.7	0	0	0	0	112.1	G192 R193	G192-V196 WeakPolarHBondContact O-CB 3.41Å; G192-V196 WeakPolarHBondContact O-CG2 3.48Å; G192-V196 PolarHBondContact O-N 2.9Å; R193-V196 PolarHBondContact O-N 3.35Å
197	S	54.3	Low	55.6	Low	69 Å²	69	130.2 Å²	130.2	48%	0.483	64%	0.641	S	S	.	*	H	α-helix	trans	-77.8	-30.5	173.4	88.8	0	0	0	0	113.1	R193 V194 R200	R193-S197 PolarHBondContact O-N 3.05Å; V194-S197 PolarHBondContact O-N 3.26Å; V194-S197 PolarHBondContact O-OG 3.45Å; S197-R200 PolarHBondContact O-N 2.98Å
198	G	48.9	Very low	55.2	Low	43 Å²	43	131.1 Å²	131.1	44%	0.443	65%	0.647	S	S	.	*	H	α-helix	trans	-70.5	-27.9	174.6	0	0	0	0	0	114.4	V194 L195 R200	V194-G198 PolarHBondContact O-N 3.27Å; L195-G198 PolarHBondContact O-N 3.11Å; G198-R200 VanDerWaalsContact C-N 3.28Å
199	I	51.3	Low	54.6	Low	132 Å²	132	133.1 Å²	133.1	68%	0.677	66%	0.659	S	S	*	*	H	α-helix	trans	-75.3	-19.8	174.3	-67.1	163.6	0	0	0	111.5	L195	L195-I199 WeakPolarHBondContact O-CD1 3.49Å; L195-I199 VanDerWaalsContact O-CG1 3.27Å; L195-I199 WeakPolarHBondContact O-CG1 3.3Å; L195-I199 PolarHBondContact O-N 3.3Å; L195-I199 VanDerWaalsContact O-N 3.16Å
200	R	47.3	Very low	53.7	Low	226 Å²	226	135.4 Å²	135.4	85%	0.853	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	1	-178.3	-136.9	174.7	-170.5	-165.8	1.5	114.8	S197 G198	S197-R200 PolarHBondContact O-N 2.98Å; G198-R200 VanDerWaalsContact C-N 3.28Å
201	L	47.3	Very low	53.1	Low	152 Å²	152	136.1 Å²	136.1	80%	0.796	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	9.5	176.9	-96.6	100.6	0	0	0	114.2
202	R	51	Low	52.4	Low	217 Å²	217	138.3 Å²	138.3	82%	0.819	68%	0.681	S	S	*	*			trans	-126.9	71.3	170.2	-67	-169.9	-165.8	173.8	4.4	110.2
203	F	43.6	Very low	51.9	Low	281 Å²	281	148.1 Å²	148.1	100%	1.232	71%	0.714	S	S	*	*			trans	-159	0	153.2	-107.7	-75.8	0	0	0	108.9

Retrieved 203 of 203 residues in 32.9 ms (Link to these results)

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