X5C3Z9_HUMAN Loading...

RUNX1/RUNX1T1 fusion protein

AlphaFold DB , UniProt , Accession X5C3Z9, Species HUMAN (Homo sapiens, Human), Gene RUNX1, Length 293 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	43.7	Very low	239 Å²	239	149 Å²	149	100%	1.177	83%	0.828	S	S	*	*				0	134.8	0	-80.5	170.9	160.7	0	0	107.2
2	A	45	Very low	43.5	Very low	92 Å²	92	146.3 Å²	146.3	76%	0.76	83%	0.827	S	S	*	*			trans	13.4	113.1	171.3	0	0	0	0	0	119.4
3	S	41.6	Very low	43	Very low	123 Å²	123	151.8 Å²	151.8	86%	0.86	83%	0.829	S	S	*	*			trans	-161.6	64.6	151	57	0	0	0	0	109.1
4	D	43.9	Very low	43.4	Very low	142 Å²	142	148.4 Å²	148.4	76%	0.759	82%	0.819	S	S	*	*			trans	-87.9	138.8	-172.2	-67.7	-80.6	0	0	0	114
5	S	51.5	Low	43.6	Very low	98 Å²	98	150.9 Å²	150.9	69%	0.685	82%	0.822	S	S	*	*			trans	41.7	96.6	148.1	-157.2	0	0	0	0	120.5
6	I	50.4	Low	43.1	Very low	170 Å²	170	148.6 Å²	148.6	87%	0.872	82%	0.819	S	S	*	*			trans	-139.4	60.5	145.3	-45	178.6	0	0	0	110
7	F	44.3	Very low	42.6	Very low	179 Å²	179	150.2 Å²	150.2	79%	0.785	82%	0.816	S	S	*	*			trans	-155.7	53.9	165.7	-149.8	-94.4	0	0	0	114.3
8	E	45.8	Very low	42.2	Very low	177 Å²	177	152.6 Å²	152.6	83%	0.827	82%	0.824	S	S	*	*			trans	-135.4	166.7	163	-77.3	-153.1	124.1	0	0	110.6
9	S	41.3	Very low	42.1	Very low	120 Å²	120	156.3 Å²	156.3	84%	0.839	83%	0.825	S	S	*	*			trans	75.4	54	179.7	-55.6	0	0	0	0	117
10	F	34.6	Very low	42.1	Very low	189 Å²	189	151.7 Å²	151.7	83%	0.829	82%	0.816	S	S	*	*			trans	-81.4	120.8	141.4	-86.7	-83.1	0	0	0	108.7	S12	F10-S12 PolarHBondContact O-N 3.14Å
11	P	42	Very low	41.8	Very low	110 Å²	110	152.3 Å²	152.3	71%	0.714	82%	0.819	S	S	*	*			trans	-63.5	119.2	175.3	-23.5	35	0	0	0	111.3	Y13	P11-Y13 PolarHBondContact O-N 2.88Å
12	S	41.3	Very low	41.9	Very low	117 Å²	117	150 Å²	150	82%	0.818	80%	0.804	S	S	*	*			trans	-68.8	113.1	172.5	-172.8	0	0	0	0	109.3	F10	F10-S12 PolarHBondContact O-N 3.14Å
13	Y	37.4	Very low	41.4	Very low	217 Å²	217	149.1 Å²	149.1	85%	0.851	80%	0.804	S	S	*	*			trans	-67	125.5	173.7	-87.1	-91.1	0	0	0	109.7	P11 Q15	P11-Y13 PolarHBondContact O-N 2.88Å; Y13-Q15 PolarHBondContact O-N 3.16Å
14	P	48.3	Very low	41.1	Very low	105 Å²	105	149.6 Å²	149.6	68%	0.682	80%	0.802	S	S	*	*			trans	-69.7	130.6	-174.7	27.3	-34.1	0	0	0	111.4	C16	P14-C16 VanDerWaalsContact C-N 3.33Å; P14-C16 PolarHBondContact O-N 3.08Å
15	Q	45.9	Very low	40.8	Very low	185 Å²	185	152.5 Å²	152.5	86%	0.864	80%	0.802	S	S	*	*			trans	-72.9	84.9	174.4	-172.7	175.8	8.7	0	0	109.9	Y13 F17	Y13-Q15 PolarHBondContact O-N 3.16Å; Q15-F17 VanDerWaalsContact C-N 3.28Å; Q15-F17 PolarHBondContact O-N 3.15Å
16	C	36.6	Very low	40.1	Very low	115 Å²	115	155.1 Å²	155.1	78%	0.777	80%	0.804	S	S	*	*			trans	-67.6	86.1	176	-80.8	0	0	0	0	111.6	P14 M18	P14-C16 VanDerWaalsContact C-N 3.33Å; P14-C16 PolarHBondContact O-N 3.08Å; C16-M18 PolarHBondContact O-N 2.74Å
17	F	34.9	Very low	39.9	Very low	176 Å²	176	153.8 Å²	153.8	77%	0.772	79%	0.794	S	S	*	*			trans	-51.2	109.4	174.5	-167.6	-91.3	0	0	0	111.4	Q15 R19	Q15-F17 VanDerWaalsContact C-N 3.28Å; Q15-F17 PolarHBondContact O-N 3.15Å; F17-R19 VanDerWaalsContact C-N 3.26Å; F17-R19 HydrophobicContact CD1-CB 3.98Å; F17-R19 HydrophobicContact CE1-CB 4.23Å; F17-R19 PolarHBondContact O-N 3.29Å
18	M	34.8	Very low	40	Very low	193 Å²	193	152.4 Å²	152.4	95%	0.951	79%	0.79	S	S	*	*			trans	-69.8	80.2	176.7	-79.2	-125.2	-65.6	0	0	111.7	C16	C16-M18 PolarHBondContact O-N 2.74Å
19	R	40.8	Very low	40.4	Very low	223 Å²	223	152.9 Å²	152.9	84%	0.842	79%	0.794	S	S	*	*			trans	-92.8	91.4	162.5	-174.3	178.9	-176.4	-156.6	0.2	107.5	F17	F17-R19 VanDerWaalsContact C-N 3.26Å; F17-R19 HydrophobicContact CD1-CB 3.98Å; F17-R19 HydrophobicContact CE1-CB 4.23Å; F17-R19 PolarHBondContact O-N 3.29Å
20	G	40.8	Very low	41.3	Very low	64 Å²	64	153.5 Å²	153.5	66%	0.66	79%	0.787	S	S	*	*			trans	-70.7	165.5	-173.8	0	0	0	0	0	114.1
21	L	36.8	Very low	42.8	Very low	165 Å²	165	149.9 Å²	149.9	86%	0.864	78%	0.776	S	S	*	*			trans	-165	156.7	147.8	-104.3	165.6	0	0	0	108.5	G23	L21-G23 PolarHBondContact O-N 3.01Å
22	H	42.2	Very low	44.3	Very low	190 Å²	190	152.7 Å²	152.7	88%	0.88	78%	0.779	S	S	*	*			trans	-57.6	126	-167.6	-59.9	-95.2	0	0	0	114.1
23	G	33.9	Very low	46	Very low	73 Å²	73	156.9 Å²	156.9	75%	0.753	78%	0.777	S	S	*	*			trans	-114.8	129.6	158.9	0	0	0	0	0	109.1	L21 R25	L21-G23 PolarHBondContact O-N 3.01Å; G23-R25 PolarHBondContact O-N 3.15Å
24	T	35.6	Very low	48.1	Very low	133 Å²	133	150.9 Å²	150.9	82%	0.816	76%	0.759	S	S	*	*			trans	-65.1	123.9	-180	43.5	0	0	0	0	110.8	Q26	T24-Q26 PolarHBondContact O-N 3.39Å
25	R	38.6	Very low	50	Low	203 Å²	203	149.2 Å²	149.2	77%	0.766	75%	0.747	S	S	*	*			trans	-72.7	75.7	170.4	-172.2	-178.3	173.7	-79.9	-4.5	110	G23 E27	G23-R25 PolarHBondContact O-N 3.15Å; R25-E27 IonicContact CZ-OE2 2.75Å; R25-E27 IonicContact NH1-OE2 3.94Å; R25-E27 PolarHBondContact NH1-OE2 2.89Å; R25-E27 IonicContact NH2-OE2 2.56Å; R25-E27 PolarHBondContact NH2-OE2 2.9Å; R25-E27 PolarHBondContact O-N 3.24Å
26	Q	35.7	Very low	52.1	Low	153 Å²	153	147.6 Å²	147.6	72%	0.715	75%	0.745	S	S	*	*			trans	-65.5	116.1	163.4	-175.1	168.6	-4.2	0	0	107.2	T24 E28	T24-Q26 PolarHBondContact O-N 3.39Å; Q26-E28 VanDerWaalsContact C-N 3.29Å; Q26-E28 HydrophobicContact CG-CG 4.44Å; Q26-E28 PolarHBondContact O-N 3.01Å
27	E	46.1	Very low	54.7	Low	142 Å²	142	149.7 Å²	149.7	66%	0.664	74%	0.736	S	S	*	*			trans	-78.4	86.8	174.4	-168.7	155.7	120.5	0	0	107.8	R25 M29	R25-E27 IonicContact CZ-OE2 2.75Å; R25-E27 IonicContact NH1-OE2 3.94Å; R25-E27 PolarHBondContact NH1-OE2 2.89Å; R25-E27 IonicContact NH2-OE2 2.56Å; R25-E27 PolarHBondContact NH2-OE2 2.9Å; R25-E27 PolarHBondContact O-N 3.24Å; E27-M29 PolarHBondContact O-N 2.93Å
28	E	45.7	Very low	57.4	Low	150 Å²	150	144.2 Å²	144.2	70%	0.701	71%	0.713	S	S	*	*			trans	-60.7	121.9	175.6	-68.1	-172	129.2	0	0	109.5	Q26 I30	Q26-E28 VanDerWaalsContact C-N 3.29Å; Q26-E28 HydrophobicContact CG-CG 4.44Å; Q26-E28 PolarHBondContact O-N 3.01Å; E28-I30 VanDerWaalsContact C-N 3.3Å; E28-I30 PolarHBondContact O-N 3.35Å
29	M	54.3	Low	60.2	Low	187 Å²	187	142 Å²	142	92%	0.921	69%	0.694	S	S	*	*			trans	-66.8	95.4	165.2	-67.2	179.7	178.6	0	0	107.3	E27 D31	E27-M29 PolarHBondContact O-N 2.93Å; M29-D31 PolarHBondContact O-N 3.4Å
30	I	61.6	Low	62.7	Low	134 Å²	134	133.4 Å²	133.4	69%	0.687	67%	0.671	S	S	*	*			trans	-58.3	105.7	-178.9	-57.7	175	0	0	0	108.2	E28 H32	E28-I30 VanDerWaalsContact C-N 3.3Å; E28-I30 PolarHBondContact O-N 3.35Å; I30-H32 PolarHBondContact O-CE1 2.99Å; I30-H32 PolarHBondContact O-N 3.15Å; I30-H32 PolarHBondContact O-ND1 3.4Å
31	D	65.2	Low	65.3	Low	112 Å²	112	135.1 Å²	135.1	60%	0.599	66%	0.662	S	S	*	*			trans	-67.7	119.3	174.3	-168.3	-8.3	0	0	0	108.3	M29 R33	M29-D31 PolarHBondContact O-N 3.4Å; D31-R33 PolarHBondContact O-N 3.5Å; D31-R33 VanDerWaalsContact OD1-CB 3.26Å; D31-R33 WeakPolarHBondContact OD1-CB 3.32Å; D31-R33 WeakPolarHBondContact OD1-CG 3.49Å; D31-R33 PolarHBondContact OD1-N 3.31Å
32	H	74.3	Confident	68.1	Low	169 Å²	169	131.8 Å²	131.8	78%	0.782	64%	0.642	S	S	*	*			trans	-76.5	-1.3	179.3	-68.9	45.9	0	0	0	111.8	I30 L34	I30-H32 PolarHBondContact O-CE1 2.99Å; I30-H32 PolarHBondContact O-N 3.15Å; I30-H32 PolarHBondContact O-ND1 3.4Å; H32-L34 PolarHBondContact O-N 3.12Å; H32-L34 VanDerWaalsContact O-N 3.12Å
33	R	77.3	Confident	70.7	Confident	206 Å²	206	129.4 Å²	129.4	78%	0.777	63%	0.625	S	S	*	*			trans	-82.7	77.3	175.8	-61.5	-179.2	68.7	-152.2	-3.6	112.1	D31 T35	D31-R33 PolarHBondContact O-N 3.5Å; D31-R33 VanDerWaalsContact OD1-CB 3.26Å; D31-R33 WeakPolarHBondContact OD1-CB 3.32Å; D31-R33 WeakPolarHBondContact OD1-CG 3.49Å; D31-R33 PolarHBondContact OD1-N 3.31Å; R33-T35 PolarHBondContact O-N 3.03Å
34	L	81.1	Confident	73.7	Confident	90 Å²	90	132.2 Å²	132.2	47%	0.471	62%	0.617	S	S	.	*			trans	-46.9	135.7	162.7	-69.8	156.8	0	0	0	110.8	H32 E38 E42	H32-L34 PolarHBondContact O-N 3.12Å; H32-L34 VanDerWaalsContact O-N 3.12Å; L34-E38 HydrophobicContact CB-CB 4.43Å; L34-E38 HydrophobicContact CD2-CB 3.75Å; L34-E42 HydrophobicContact CD2-CG 4.42Å
35	T	88.3	Confident	76.7	Confident	70 Å²	70	130.5 Å²	130.5	43%	0.429	60%	0.599	S	S	.	*			trans	-72.8	160.3	169.2	66.6	0	0	0	0	110.9	R33 R37 E38 W39	R33-T35 PolarHBondContact O-N 3.03Å; T35-R37 PolarHBondContact O-N 2.91Å; T35-E38 VanDerWaalsContact CB-OE2 3.28Å; T35-E38 WeakPolarHBondContact CB-OE2 3.16Å; T35-E38 WeakPolarHBondContact CG2-OE2 3.29Å; T35-E38 PolarHBondContact N-OE2 3.37Å; T35-E38 PolarHBondContact O-N 2.98Å; T35-E38 PolarHBondContact OG1-OE1 3.17Å; T35-E38 PolarHBondContact OG1-OE2 3.26Å; T35-W39 WeakPolarHBondContact O-CB 3.47Å; T35-W39 PolarHBondContact O-N 3.41Å
36	D	89.9	Confident	79.5	Confident	152 Å²	152	124.7 Å²	124.7	81%	0.813	58%	0.583	S	S	*	*	H	α-helix	trans	-53.9	-30	179.5	-61.3	-43.6	0	0	0	113.2	A40	D36-A40 VanDerWaalsContact O-CB 3.28Å; D36-A40 WeakPolarHBondContact O-CB 3.39Å; D36-A40 PolarHBondContact O-N 2.83Å
37	R	90.6	Very high	82.4	Confident	158 Å²	158	122 Å²	122	60%	0.596	57%	0.573	S	S	*	*	H	α-helix	trans	-70.1	-51.7	174.7	179.2	-170.9	61.9	-177.9	-2.2	111.7	T35 W39 A40 E41	T35-R37 PolarHBondContact O-N 2.91Å; R37-W39 VanDerWaalsContact C-N 3.3Å; R37-W39 PolarHBondContact O-N 3.14Å; R37-A40 CarbonylContact O-C 3.6Å; R37-A40 PolarHBondContact O-N 2.79Å; R37-A40 VanDerWaalsContact O-N 3.14Å; R37-E41 WeakPolarHBondContact CG-OE1 2.96Å; R37-E41 WeakPolarHBondContact O-CG 3.41Å; R37-E41 PolarHBondContact O-N 2.81Å
38	E	91.4	Very high	84.9	Confident	62 Å²	62	120.5 Å²	120.5	29%	0.29	57%	0.566	S	S	.	*	H	α-helix	trans	-64.4	-37.9	179.6	-72.6	129.6	-163.2	0	0	110.8	L34 T35 A40 E41 E42	L34-E38 HydrophobicContact CB-CB 4.43Å; L34-E38 HydrophobicContact CD2-CB 3.75Å; T35-E38 VanDerWaalsContact CB-OE2 3.28Å; T35-E38 WeakPolarHBondContact CB-OE2 3.16Å; T35-E38 WeakPolarHBondContact CG2-OE2 3.29Å; T35-E38 PolarHBondContact N-OE2 3.37Å; T35-E38 PolarHBondContact O-N 2.98Å; T35-E38 PolarHBondContact OG1-OE1 3.17Å; T35-E38 PolarHBondContact OG1-OE2 3.26Å; E38-A40 VanDerWaalsContact C-N 3.34Å; E38-A40 PolarHBondContact O-N 3.44Å; E38-E41 PolarHBondContact O-N 2.95Å; E38-E42 PolarHBondContact O-N 3.33Å
39	W	94.3	Very high	87.4	Confident	145 Å²	145	117.1 Å²	117.1	55%	0.549	55%	0.552	S	S	.	*	H	α-helix	trans	-59.1	-45.3	171.7	-145.2	74.1	0	0	0	111.2	T35 R37 E41 E42 W43	T35-W39 WeakPolarHBondContact O-CB 3.47Å; T35-W39 PolarHBondContact O-N 3.41Å; R37-W39 VanDerWaalsContact C-N 3.3Å; R37-W39 PolarHBondContact O-N 3.14Å; W39-E41 PolarHBondContact O-N 3.04Å; W39-E42 PolarHBondContact O-N 3.21Å; W39-W43 AromaticContact CD2-CD1 3.67Å; W39-W43 AromaticContact CD2-NE1 3.51Å; W39-W43 AromaticContact CE2-NE1 3.44Å; W39-W43 AromaticContact CE3-CD1 3.41Å; W39-W43 VanDerWaalsContact CE3-CD1 3.41Å; W39-W43 AromaticContact CE3-NE1 3.34Å; W39-W43 VanDerWaalsContact CE3-NE1 3.34Å; W39-W43 AromaticContact CH2-CE2 3.84Å; W39-W43 HydrophobicContact CH2-CZ2 4.09Å; W39-W43 AromaticContact CH2-NE1 3.09Å; W39-W43 HydrophobicContact CZ2-CZ2 4.33Å; W39-W43 AromaticContact CZ2-NE1 3.25Å; W39-W43 AromaticContact CZ3-CD1 3.61Å; W39-W43 AromaticContact CZ3-NE1 3.14Å; W39-W43 PolarHBondContact O-N 3.36Å
40	A	93.9	Very high	89.5	Confident	43 Å²	43	113.2 Å²	113.2	36%	0.355	54%	0.535	S	S	.	.	H	α-helix	trans	-71.1	-8.7	174.7	0	0	0	0	0	114.4	D36 R37 E38 K44	D36-A40 VanDerWaalsContact O-CB 3.28Å; D36-A40 WeakPolarHBondContact O-CB 3.39Å; D36-A40 PolarHBondContact O-N 2.83Å; R37-A40 CarbonylContact O-C 3.6Å; R37-A40 PolarHBondContact O-N 2.79Å; R37-A40 VanDerWaalsContact O-N 3.14Å; E38-A40 VanDerWaalsContact C-N 3.34Å; E38-A40 PolarHBondContact O-N 3.44Å; A40-K44 VanDerWaalsContact O-CD 3.26Å; A40-K44 WeakPolarHBondContact O-CD 3.28Å; A40-K44 WeakPolarHBondContact O-CE 3.41Å; A40-K44 VanDerWaalsContact O-CG 3.28Å; A40-K44 WeakPolarHBondContact O-CG 3.25Å; A40-K44 PolarHBondContact O-NZ 3.25Å
41	E	94.9	Very high	91.2	Very high	100 Å²	100	110.2 Å²	110.2	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-93.9	-43.2	172.1	-75.6	166.8	-166.8	0	0	110.3	R37 E38 W39 W43 K44 H45	R37-E41 WeakPolarHBondContact CG-OE1 2.96Å; R37-E41 WeakPolarHBondContact O-CG 3.41Å; R37-E41 PolarHBondContact O-N 2.81Å; E38-E41 PolarHBondContact O-N 2.95Å; W39-E41 PolarHBondContact O-N 3.04Å; E41-W43 PolarHBondContact O-N 2.89Å; E41-K44 WeakPolarHBondContact O-CB 3.28Å; E41-K44 PolarHBondContact O-N 2.98Å; E41-K44 VanDerWaalsContact O-N 3.09Å; E41-H45 PolarHBondContact O-N 2.9Å
42	E	95	Very high	92.8	Very high	95 Å²	95	107.3 Å²	107.3	44%	0.444	51%	0.508	S	S	.	.	H	α-helix	trans	-58.6	-41.6	171.7	-75.5	-63.7	99.2	0	0	112.6	L34 E38 W39 K44 H45 L46	L34-E42 HydrophobicContact CD2-CG 4.42Å; E38-E42 PolarHBondContact O-N 3.33Å; W39-E42 PolarHBondContact O-N 3.21Å; E42-K44 VanDerWaalsContact C-N 3.32Å; E42-K44 PolarHBondContact O-N 2.76Å; E42-H45 WeakPolarHBondContact O-CB 3.2Å; E42-H45 PolarHBondContact O-N 3.29Å; E42-H45 VanDerWaalsContact O-N 3.14Å; E42-L46 WeakPolarHBondContact O-CG 3.44Å; E42-L46 PolarHBondContact O-N 3.33Å
43	W	96.9	Very high	94	Very high	141 Å²	141	104.1 Å²	104.1	53%	0.534	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-32.3	174.7	-84.1	103	0	0	0	113.5	W39 E41 L46 D47	W39-W43 AromaticContact CD2-CD1 3.67Å; W39-W43 AromaticContact CD2-NE1 3.51Å; W39-W43 AromaticContact CE2-NE1 3.44Å; W39-W43 AromaticContact CE3-CD1 3.41Å; W39-W43 VanDerWaalsContact CE3-CD1 3.41Å; W39-W43 AromaticContact CE3-NE1 3.34Å; W39-W43 VanDerWaalsContact CE3-NE1 3.34Å; W39-W43 AromaticContact CH2-CE2 3.84Å; W39-W43 HydrophobicContact CH2-CZ2 4.09Å; W39-W43 AromaticContact CH2-NE1 3.09Å; W39-W43 HydrophobicContact CZ2-CZ2 4.33Å; W39-W43 AromaticContact CZ2-NE1 3.25Å; W39-W43 AromaticContact CZ3-CD1 3.61Å; W39-W43 AromaticContact CZ3-NE1 3.14Å; W39-W43 PolarHBondContact O-N 3.36Å; E41-W43 PolarHBondContact O-N 2.89Å; W43-L46 HydrophobicContact CE3-CD1 4.4Å; W43-D47 WeakPolarHBondContact O-CB 3.33Å; W43-D47 PolarHBondContact O-N 2.83Å
44	K	97.6	Very high	94.9	Very high	132 Å²	132	99.6 Å²	99.6	57%	0.574	49%	0.485	S	S	*	.	H	α-helix	trans	-72.2	-34.5	172.1	-65.9	169.7	-166	123.8	0	111.2	A40 E41 E42 H48	A40-K44 VanDerWaalsContact O-CD 3.26Å; A40-K44 WeakPolarHBondContact O-CD 3.28Å; A40-K44 WeakPolarHBondContact O-CE 3.41Å; A40-K44 VanDerWaalsContact O-CG 3.28Å; A40-K44 WeakPolarHBondContact O-CG 3.25Å; A40-K44 PolarHBondContact O-NZ 3.25Å; E41-K44 WeakPolarHBondContact O-CB 3.28Å; E41-K44 PolarHBondContact O-N 2.98Å; E41-K44 VanDerWaalsContact O-N 3.09Å; E42-K44 VanDerWaalsContact C-N 3.32Å; E42-K44 PolarHBondContact O-N 2.76Å; K44-H48 VanDerWaalsContact O-CB 3.25Å; K44-H48 WeakPolarHBondContact O-CB 3.42Å; K44-H48 PolarHBondContact O-N 3.05Å
45	H	97.3	Very high	95.8	Very high	97 Å²	97	98.5 Å²	98.5	45%	0.449	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-46.1	174.7	-172.5	57.7	0	0	0	111.1	E41 E42 H48 L49	E41-H45 PolarHBondContact O-N 2.9Å; E42-H45 WeakPolarHBondContact O-CB 3.2Å; E42-H45 PolarHBondContact O-N 3.29Å; E42-H45 VanDerWaalsContact O-N 3.14Å; H45-H48 PolarHBondContact O-N 3.47Å; H45-L49 WeakPolarHBondContact O-CG 3.41Å; H45-L49 PolarHBondContact O-N 3.1Å
46	L	97.9	Very high	96.2	Very high	80 Å²	80	101.3 Å²	101.3	42%	0.419	49%	0.489	S	S	.	.	H	α-helix	trans	-59.9	-47.9	174.1	-73.4	169.4	0	0	0	112.4	E42 W43 H48 L49 L50	E42-L46 WeakPolarHBondContact O-CG 3.44Å; E42-L46 PolarHBondContact O-N 3.33Å; W43-L46 HydrophobicContact CE3-CD1 4.4Å; L46-H48 VanDerWaalsContact C-N 3.34Å; L46-H48 PolarHBondContact O-N 2.73Å; L46-L49 PolarHBondContact O-N 2.84Å; L46-L50 VanDerWaalsContact O-CG 3.32Å; L46-L50 WeakPolarHBondContact O-CG 3.44Å; L46-L50 PolarHBondContact O-N 3.07Å
47	D	97.7	Very high	96.6	Very high	97 Å²	97	98.7 Å²	98.7	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-59.4	-43.7	174.7	177.7	80.1	0	0	0	111.7	W43 L49 L50 N51	W43-D47 WeakPolarHBondContact O-CB 3.33Å; W43-D47 PolarHBondContact O-N 2.83Å; D47-L49 PolarHBondContact O-N 2.84Å; D47-L50 PolarHBondContact O-N 2.86Å; D47-N51 VanDerWaalsContact CG-ND2 3.3Å; D47-N51 WeakPolarHBondContact O-CB 3.22Å; D47-N51 PolarHBondContact O-N 2.98Å; D47-N51 PolarHBondContact O-ND2 2.88Å; D47-N51 PolarHBondContact OD1-ND2 3.28Å; D47-N51 PolarHBondContact OD2-ND2 3.14Å
48	H	98.1	Very high	97	Very high	111 Å²	111	93.2 Å²	93.2	51%	0.514	46%	0.459	S	S	.	.	H	α-helix	trans	-62.8	-41.7	176.5	-177.7	66.8	0	0	0	112.8	K44 H45 L46 N51 C52	K44-H48 VanDerWaalsContact O-CB 3.25Å; K44-H48 WeakPolarHBondContact O-CB 3.42Å; K44-H48 PolarHBondContact O-N 3.05Å; H45-H48 PolarHBondContact O-N 3.47Å; L46-H48 VanDerWaalsContact C-N 3.34Å; L46-H48 PolarHBondContact O-N 2.73Å; H48-N51 PolarHBondContact O-N 3.24Å; H48-C52 WeakPolarHBondContact O-CB 3.42Å; H48-C52 PolarHBondContact O-N 2.82Å; H48-C52 PolarHBondContact O-SG 2.89Å; H48-C52 VanDerWaalsContact O-SG 3.4Å
49	L	98.3	Very high	97.3	Very high	78 Å²	78	95.9 Å²	95.9	41%	0.408	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-43.7	175.6	-71.9	171.9	0	0	0	111.7	H45 L46 D47 C52 I53	H45-L49 WeakPolarHBondContact O-CG 3.41Å; H45-L49 PolarHBondContact O-N 3.1Å; L46-L49 PolarHBondContact O-N 2.84Å; D47-L49 PolarHBondContact O-N 2.84Å; L49-C52 PolarHBondContact O-N 3.07Å; L49-I53 WeakPolarHBondContact O-CG1 3.42Å; L49-I53 PolarHBondContact O-N 2.87Å
50	L	98.3	Very high	97.5	Very high	106 Å²	106	92.7 Å²	92.7	56%	0.555	47%	0.467	S	S	*	.	H	α-helix	trans	-63.5	-42.5	176.4	-69.6	171.2	0	0	0	111.7	L46 D47 I53 M54	L46-L50 VanDerWaalsContact O-CG 3.32Å; L46-L50 WeakPolarHBondContact O-CG 3.44Å; L46-L50 PolarHBondContact O-N 3.07Å; D47-L50 PolarHBondContact O-N 2.86Å; L50-I53 PolarHBondContact O-N 2.72Å; L50-M54 WeakPolarHBondContact O-CG 3.3Å; L50-M54 PolarHBondContact O-N 3.38Å
51	N	98.1	Very high	97.7	Very high	71 Å²	71	98.2 Å²	98.2	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-62.7	-41.1	174.3	-80.1	-60.2	0	0	0	112.4	D47 H48 M54 D55	D47-N51 VanDerWaalsContact CG-ND2 3.3Å; D47-N51 WeakPolarHBondContact O-CB 3.22Å; D47-N51 PolarHBondContact O-N 2.98Å; D47-N51 PolarHBondContact O-ND2 2.88Å; D47-N51 PolarHBondContact OD1-ND2 3.28Å; D47-N51 PolarHBondContact OD2-ND2 3.14Å; H48-N51 PolarHBondContact O-N 3.24Å; N51-M54 PolarHBondContact O-N 3.11Å; N51-M54 VanDerWaalsContact OD1-CE 3.22Å; N51-M54 WeakPolarHBondContact OD1-CE 3.49Å; N51-D55 PolarHBondContact O-N 2.95Å
52	C	98.4	Very high	97.9	Very high	51 Å²	51	100.6 Å²	100.6	35%	0.345	48%	0.483	S	S	.	.	H	α-helix	trans	-61.8	-41.4	173.1	-78.6	0	0	0	0	112.5	H48 L49 D55 M56	H48-C52 WeakPolarHBondContact O-CB 3.42Å; H48-C52 PolarHBondContact O-N 2.82Å; H48-C52 PolarHBondContact O-SG 2.89Å; H48-C52 VanDerWaalsContact O-SG 3.4Å; L49-C52 PolarHBondContact O-N 3.07Å; C52-D55 PolarHBondContact O-N 2.85Å; C52-M56 WeakPolarHBondContact O-CG 3.19Å; C52-M56 PolarHBondContact O-N 3.13Å
53	I	98.1	Very high	98	Very high	101 Å²	101	99.2 Å²	99.2	52%	0.518	48%	0.484	S	S	.	.	H	α-helix	trans	-62.7	-44.6	174.9	-68.6	163.6	0	0	0	110.7	L49 L50 M56 V57	L49-I53 WeakPolarHBondContact O-CG1 3.42Å; L49-I53 PolarHBondContact O-N 2.87Å; L50-I53 PolarHBondContact O-N 2.72Å; I53-M56 PolarHBondContact O-N 2.73Å; I53-V57 WeakPolarHBondContact O-CG2 3.3Å; I53-V57 PolarHBondContact O-N 3.04Å
54	M	97.8	Very high	98.1	Very high	112 Å²	112	96.9 Å²	96.9	55%	0.552	48%	0.481	S	S	*	.	H	α-helix	trans	-62.7	-42	177.7	-71.4	-170.1	-66.8	0	0	112.5	L50 N51 V57 E58	L50-M54 WeakPolarHBondContact O-CG 3.3Å; L50-M54 PolarHBondContact O-N 3.38Å; N51-M54 PolarHBondContact O-N 3.11Å; N51-M54 VanDerWaalsContact OD1-CE 3.22Å; N51-M54 WeakPolarHBondContact OD1-CE 3.49Å; M54-V57 PolarHBondContact O-N 3.37Å; M54-E58 WeakPolarHBondContact O-CB 3.38Å; M54-E58 PolarHBondContact O-N 2.8Å
55	D	98.4	Very high	98.1	Very high	67 Å²	67	93.9 Å²	93.9	36%	0.358	48%	0.475	S	S	.	.	H	α-helix	trans	-65.9	-38.9	175.3	170.3	66	0	0	0	112.4	N51 C52 V57 E58 K59	N51-D55 PolarHBondContact O-N 2.95Å; C52-D55 PolarHBondContact O-N 2.85Å; D55-V57 PolarHBondContact O-N 3.25Å; D55-E58 PolarHBondContact O-N 3.02Å; D55-K59 WeakPolarHBondContact O-CB 3.34Å; D55-K59 VanDerWaalsContact O-CG 3.3Å; D55-K59 WeakPolarHBondContact O-CG 3.28Å; D55-K59 PolarHBondContact O-N 2.67Å; D55-K59 WeakPolarHBondContact OD1-CE 3.5Å; D55-K59 IonicContact OD1-NZ 3.49Å; D55-K59 WeakPolarHBondContact OD2-CD 3.36Å; D55-K59 WeakPolarHBondContact OD2-CE 3.34Å; D55-K59 IonicContact OD2-NZ 3.56Å; D55-K59 PolarHBondContact OD2-NZ 3.23Å
56	M	98	Very high	98.2	Very high	129 Å²	129	93.6 Å²	93.6	64%	0.635	48%	0.479	S	S	*	.	H	α-helix	trans	-62.7	-40.8	172.5	-73.7	-175.4	72	0	0	112.4	C52 I53 T60	C52-M56 WeakPolarHBondContact O-CG 3.19Å; C52-M56 PolarHBondContact O-N 3.13Å; I53-M56 PolarHBondContact O-N 2.73Å; M56-T60 WeakPolarHBondContact O-CB 3.4Å; M56-T60 PolarHBondContact O-N 3.22Å; M56-T60 PolarHBondContact O-OG1 3.35Å
57	V	98.7	Very high	98.2	Very high	96 Å²	96	94.7 Å²	94.7	58%	0.582	49%	0.485	S	S	*	.	H	α-helix	trans	-64.3	-42.1	174.1	170	0	0	0	0	111	I53 M54 D55 T60 R61	I53-V57 WeakPolarHBondContact O-CG2 3.3Å; I53-V57 PolarHBondContact O-N 3.04Å; M54-V57 PolarHBondContact O-N 3.37Å; D55-V57 PolarHBondContact O-N 3.25Å; V57-T60 WeakPolarHBondContact O-CB 3.41Å; V57-T60 PolarHBondContact O-N 2.85Å; V57-R61 PolarHBondContact O-N 3.2Å
58	E	98.6	Very high	98.2	Very high	43 Å²	43	97.6 Å²	97.6	20%	0.201	49%	0.489	C	S	.	.	H	α-helix	trans	-68.3	-41.7	179	173.9	58.7	-179.3	0	0	112.6	M54 D55 T60 R61 R62	M54-E58 WeakPolarHBondContact O-CB 3.38Å; M54-E58 PolarHBondContact O-N 2.8Å; D55-E58 PolarHBondContact O-N 3.02Å; E58-T60 VanDerWaalsContact C-N 3.28Å; E58-T60 PolarHBondContact O-N 3.48Å; E58-R61 PolarHBondContact O-N 3.06Å; E58-R61 IonicContact OE1-CZ 3.74Å; E58-R61 IonicContact OE1-NH2 3.14Å; E58-R61 PolarHBondContact OE1-NH2 2.97Å; E58-R61 IonicContact OE2-CZ 3.54Å; E58-R61 IonicContact OE2-NE 2.62Å; E58-R61 PolarHBondContact OE2-NE 2.93Å; E58-R61 IonicContact OE2-NH2 2.79Å; E58-R61 PolarHBondContact OE2-NH2 2.56Å; E58-R62 VanDerWaalsContact CG-NH2 3.28Å; E58-R62 WeakPolarHBondContact O-CG 3.33Å; E58-R62 PolarHBondContact O-N 3.11Å; E58-R62 IonicContact OE1-CZ 3.61Å; E58-R62 IonicContact OE1-NE 2.66Å; E58-R62 PolarHBondContact OE1-NE 3.44Å; E58-R62 IonicContact OE1-NH2 2.67Å; E58-R62 PolarHBondContact OE1-NH2 3.01Å
59	K	96.9	Very high	98.2	Very high	118 Å²	118	100.7 Å²	100.7	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-58.6	-41.5	170.4	-75.9	167	174.4	167.4	0	111.3	D55 R62 S63	D55-K59 WeakPolarHBondContact O-CB 3.34Å; D55-K59 VanDerWaalsContact O-CG 3.3Å; D55-K59 WeakPolarHBondContact O-CG 3.28Å; D55-K59 PolarHBondContact O-N 2.67Å; D55-K59 WeakPolarHBondContact OD1-CE 3.5Å; D55-K59 IonicContact OD1-NZ 3.49Å; D55-K59 WeakPolarHBondContact OD2-CD 3.36Å; D55-K59 WeakPolarHBondContact OD2-CE 3.34Å; D55-K59 IonicContact OD2-NZ 3.56Å; D55-K59 PolarHBondContact OD2-NZ 3.23Å; K59-R62 PolarHBondContact O-N 3.01Å; K59-S63 WeakPolarHBondContact O-CB 3.49Å; K59-S63 PolarHBondContact O-N 3.25Å
60	T	98.6	Very high	98.1	Very high	78 Å²	78	100 Å²	100	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-44.5	175.1	-56.7	0	0	0	0	111.5	M56 V57 E58 R62 S63 L64	M56-T60 WeakPolarHBondContact O-CB 3.4Å; M56-T60 PolarHBondContact O-N 3.22Å; M56-T60 PolarHBondContact O-OG1 3.35Å; V57-T60 WeakPolarHBondContact O-CB 3.41Å; V57-T60 PolarHBondContact O-N 2.85Å; E58-T60 VanDerWaalsContact C-N 3.28Å; E58-T60 PolarHBondContact O-N 3.48Å; T60-R62 VanDerWaalsContact C-N 3.33Å; T60-R62 PolarHBondContact O-N 2.61Å; T60-S63 PolarHBondContact O-N 3.32Å; T60-L64 HydrophobicContact CG2-CD1 4.13Å; T60-L64 HydrophobicContact CG2-CG 4.48Å; T60-L64 WeakPolarHBondContact O-CG 3.46Å; T60-L64 PolarHBondContact O-N 3.25Å
61	R	98.6	Very high	98.1	Very high	159 Å²	159	101.3 Å²	101.3	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-59.4	-40.9	175.8	-171.5	176.5	70	136.8	3	112.3	V57 E58 T65	V57-R61 PolarHBondContact O-N 3.2Å; E58-R61 PolarHBondContact O-N 3.06Å; E58-R61 IonicContact OE1-CZ 3.74Å; E58-R61 IonicContact OE1-NH2 3.14Å; E58-R61 PolarHBondContact OE1-NH2 2.97Å; E58-R61 IonicContact OE2-CZ 3.54Å; E58-R61 IonicContact OE2-NE 2.62Å; E58-R61 PolarHBondContact OE2-NE 2.93Å; E58-R61 IonicContact OE2-NH2 2.79Å; E58-R61 PolarHBondContact OE2-NH2 2.56Å; R61-T65 PolarHBondContact O-N 3.42Å; R61-T65 PolarHBondContact O-OG1 2.8Å
62	R	98.5	Very high	98.1	Very high	150 Å²	150	102.2 Å²	102.2	57%	0.566	50%	0.502	S	S	*	.	H	α-helix	trans	-67.4	-44.8	175.5	-67.5	171.8	-169	174.7	6.8	111.7	E58 K59 T60 L64 T65 V66	E58-R62 VanDerWaalsContact CG-NH2 3.28Å; E58-R62 WeakPolarHBondContact O-CG 3.33Å; E58-R62 PolarHBondContact O-N 3.11Å; E58-R62 IonicContact OE1-CZ 3.61Å; E58-R62 IonicContact OE1-NE 2.66Å; E58-R62 PolarHBondContact OE1-NE 3.44Å; E58-R62 IonicContact OE1-NH2 2.67Å; E58-R62 PolarHBondContact OE1-NH2 3.01Å; K59-R62 PolarHBondContact O-N 3.01Å; T60-R62 VanDerWaalsContact C-N 3.33Å; T60-R62 PolarHBondContact O-N 2.61Å; R62-L64 PolarHBondContact O-N 3.22Å; R62-T65 VanDerWaalsContact O-CB 3.32Å; R62-T65 WeakPolarHBondContact O-CB 3.5Å; R62-T65 PolarHBondContact O-N 2.8Å; R62-V66 PolarHBondContact O-N 3.35Å
63	S	98.4	Very high	98	Very high	66 Å²	66	102.1 Å²	102.1	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-57.9	-48.3	175.7	-175.8	0	0	0	0	112.2	K59 T60 T65 V66 L67	K59-S63 WeakPolarHBondContact O-CB 3.49Å; K59-S63 PolarHBondContact O-N 3.25Å; T60-S63 PolarHBondContact O-N 3.32Å; S63-T65 PolarHBondContact O-N 3.21Å; S63-V66 PolarHBondContact O-N 2.99Å; S63-L67 WeakPolarHBondContact O-CG 3.28Å; S63-L67 PolarHBondContact O-N 3.48Å
64	L	97.8	Very high	97.9	Very high	92 Å²	92	102.8 Å²	102.8	48%	0.482	51%	0.51	S	S	.	.	H	α-helix	trans	-60.6	-26.9	175	-69.8	170.8	0	0	0	113.3	T60 R62 L67 R68	T60-L64 HydrophobicContact CG2-CD1 4.13Å; T60-L64 HydrophobicContact CG2-CG 4.48Å; T60-L64 WeakPolarHBondContact O-CG 3.46Å; T60-L64 PolarHBondContact O-N 3.25Å; R62-L64 PolarHBondContact O-N 3.22Å; L64-L67 HydrophobicContact CD2-CD1 4.39Å; L64-R68 VanDerWaalsContact O-CG 3.29Å; L64-R68 WeakPolarHBondContact O-CG 3.37Å; L64-R68 PolarHBondContact O-N 3.01Å; L64-R68 VanDerWaalsContact O-N 3.11Å
65	T	98.3	Very high	97.9	Very high	70 Å²	70	104 Å²	104	43%	0.429	51%	0.508	S	S	.	.	H	α-helix	trans	-72.9	-36.8	174.5	-54.1	0	0	0	0	111.8	R61 R62 S63 R69	R61-T65 PolarHBondContact O-N 3.42Å; R61-T65 PolarHBondContact O-OG1 2.8Å; R62-T65 VanDerWaalsContact O-CB 3.32Å; R62-T65 WeakPolarHBondContact O-CB 3.5Å; R62-T65 PolarHBondContact O-N 2.8Å; S63-T65 PolarHBondContact O-N 3.21Å; T65-R69 PolarHBondContact O-N 2.93Å
66	V	98.4	Very high	97.9	Very high	91 Å²	91	106.5 Å²	106.5	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-68.6	-47	173.4	179.1	0	0	0	0	110.4	R62 S63 R68 R69 C70	R62-V66 PolarHBondContact O-N 3.35Å; S63-V66 PolarHBondContact O-N 2.99Å; V66-R68 VanDerWaalsContact C-N 3.31Å; V66-R68 PolarHBondContact O-N 3.1Å; V66-R69 WeakPolarHBondContact O-CB 3.22Å; V66-R69 PolarHBondContact O-N 3.29Å; V66-C70 PolarHBondContact O-N 3.38Å; V66-C70 PolarHBondContact O-SG 3.34Å
67	L	98.1	Very high	97.8	Very high	102 Å²	102	106.4 Å²	106.4	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-59	-38.3	179.1	-69.9	169.3	0	0	0	112.9	S63 L64 C70 Q71	S63-L67 WeakPolarHBondContact O-CG 3.28Å; S63-L67 PolarHBondContact O-N 3.48Å; L64-L67 HydrophobicContact CD2-CD1 4.39Å; L67-C70 PolarHBondContact O-N 2.83Å; L67-Q71 PolarHBondContact O-N 2.8Å
68	R	98.1	Very high	97.6	Very high	159 Å²	159	106.9 Å²	106.9	60%	0.6	51%	0.514	S	S	*	.	H	α-helix	trans	-61.7	-41.8	172.8	-77.9	170.7	-178.3	-86.6	0.2	112.6	L64 V66 Q71 E72	L64-R68 VanDerWaalsContact O-CG 3.29Å; L64-R68 WeakPolarHBondContact O-CG 3.37Å; L64-R68 PolarHBondContact O-N 3.01Å; L64-R68 VanDerWaalsContact O-N 3.11Å; V66-R68 VanDerWaalsContact C-N 3.31Å; V66-R68 PolarHBondContact O-N 3.1Å; R68-Q71 WeakPolarHBondContact O-CB 3.26Å; R68-Q71 PolarHBondContact O-N 3.35Å; R68-E72 WeakPolarHBondContact O-CB 3.43Å; R68-E72 VanDerWaalsContact O-CG 3.27Å; R68-E72 WeakPolarHBondContact O-CG 3.38Å; R68-E72 PolarHBondContact O-N 3.33Å
69	R	98.1	Very high	97.5	Very high	175 Å²	175	108.2 Å²	108.2	66%	0.66	52%	0.523	S	S	*	.	H	α-helix	trans	-66.3	-37.4	177	-70.9	176.4	176.7	-175.4	-1.5	112.5	T65 V66 E72 A73	T65-R69 PolarHBondContact O-N 2.93Å; V66-R69 WeakPolarHBondContact O-CB 3.22Å; V66-R69 PolarHBondContact O-N 3.29Å; R69-E72 PolarHBondContact O-N 2.83Å; R69-A73 WeakPolarHBondContact O-CB 3.34Å; R69-A73 PolarHBondContact O-N 3.13Å
70	C	96.4	Very high	97.5	Very high	63 Å²	63	108.8 Å²	108.8	43%	0.426	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-50.8	171.1	-63.8	0	0	0	0	110.8	V66 L67 E72 A73 D74	V66-C70 PolarHBondContact O-N 3.38Å; V66-C70 PolarHBondContact O-SG 3.34Å; L67-C70 PolarHBondContact O-N 2.83Å; C70-E72 VanDerWaalsContact C-N 3.28Å; C70-E72 PolarHBondContact O-N 3.02Å; C70-A73 PolarHBondContact O-N 3.47Å; C70-A73 VanDerWaalsContact O-N 3.12Å; C70-D74 PolarHBondContact O-N 2.92Å
71	Q	97.9	Very high	97.3	Very high	134 Å²	134	112.5 Å²	112.5	63%	0.626	53%	0.528	S	S	*	.	H	α-helix	trans	-58.4	-37.8	176.8	-173.1	-171.3	13.3	0	0	113	L67 R68 R75	L67-Q71 PolarHBondContact O-N 2.8Å; R68-Q71 WeakPolarHBondContact O-CB 3.26Å; R68-Q71 PolarHBondContact O-N 3.35Å; Q71-R75 VanDerWaalsContact O-CB 3.24Å; Q71-R75 WeakPolarHBondContact O-CB 3.14Å; Q71-R75 PolarHBondContact O-N 3.49Å; Q71-R75 VanDerWaalsContact O-N 3.13Å
72	E	97.6	Very high	97.1	Very high	90 Å²	90	109.6 Å²	109.6	42%	0.421	52%	0.524	S	S	.	.	H	α-helix	trans	-66.3	-42.7	176.2	-76	161.6	179.1	0	0	111.5	R68 R69 C70 R75 E76	R68-E72 WeakPolarHBondContact O-CB 3.43Å; R68-E72 VanDerWaalsContact O-CG 3.27Å; R68-E72 WeakPolarHBondContact O-CG 3.38Å; R68-E72 PolarHBondContact O-N 3.33Å; R69-E72 PolarHBondContact O-N 2.83Å; C70-E72 VanDerWaalsContact C-N 3.28Å; C70-E72 PolarHBondContact O-N 3.02Å; E72-R75 PolarHBondContact O-N 3.07Å; E72-E76 WeakPolarHBondContact O-CG 3.26Å; E72-E76 PolarHBondContact O-N 2.99Å
73	A	96.6	Very high	96.9	Very high	50 Å²	50	109.7 Å²	109.7	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-66.4	-46.9	175.3	0	0	0	0	0	112.8	R69 C70 R75 E76 E77	R69-A73 WeakPolarHBondContact O-CB 3.34Å; R69-A73 PolarHBondContact O-N 3.13Å; C70-A73 PolarHBondContact O-N 3.47Å; C70-A73 VanDerWaalsContact O-N 3.12Å; A73-R75 PolarHBondContact O-N 3.12Å; A73-E76 CarbonylContact O-C 3.46Å; A73-E76 WeakPolarHBondContact O-CA 3.28Å; A73-E76 PolarHBondContact O-N 2.86Å; A73-E77 PolarHBondContact O-N 2.93Å
74	D	97.4	Very high	96.7	Very high	115 Å²	115	113 Å²	113	62%	0.615	53%	0.526	S	S	*	.	H	α-helix	trans	-56.3	-41.4	176.3	-63.5	-22.7	0	0	0	111.1	C70 L78	C70-D74 PolarHBondContact O-N 2.92Å; D74-L78 WeakPolarHBondContact O-CB 3.45Å; D74-L78 PolarHBondContact O-N 3.01Å
75	R	97.1	Very high	96.1	Very high	137 Å²	137	116.4 Å²	116.4	52%	0.517	53%	0.534	S	S	.	.	H	α-helix	trans	-67.4	-36.2	175.4	-179.1	-166.6	65.4	156.4	1.1	111.8	Q71 E72 A73 N79	Q71-R75 VanDerWaalsContact O-CB 3.24Å; Q71-R75 WeakPolarHBondContact O-CB 3.14Å; Q71-R75 PolarHBondContact O-N 3.49Å; Q71-R75 VanDerWaalsContact O-N 3.13Å; E72-R75 PolarHBondContact O-N 3.07Å; A73-R75 PolarHBondContact O-N 3.12Å; R75-N79 PolarHBondContact O-N 2.93Å; R75-N79 PolarHBondContact O-ND2 3.46Å
76	E	97.3	Very high	95.7	Very high	119 Å²	119	115.9 Å²	115.9	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-71.8	-39.9	177.4	-78.7	172.1	-157.9	0	0	112.1	E72 A73 N79 Y80	E72-E76 WeakPolarHBondContact O-CG 3.26Å; E72-E76 PolarHBondContact O-N 2.99Å; A73-E76 CarbonylContact O-C 3.46Å; A73-E76 WeakPolarHBondContact O-CA 3.28Å; A73-E76 PolarHBondContact O-N 2.86Å; E76-N79 PolarHBondContact O-N 3.27Å; E76-Y80 WeakPolarHBondContact O-CB 3.26Å; E76-Y80 PolarHBondContact O-N 2.81Å
77	E	95.9	Very high	95.3	Very high	128 Å²	128	116.5 Å²	116.5	60%	0.598	53%	0.533	S	S	*	.	H	α-helix	trans	-60.4	-46.7	169.5	-74	-150.1	174.9	0	0	111.7	A73 N79 Y80 W81	A73-E77 PolarHBondContact O-N 2.93Å; E77-N79 VanDerWaalsContact C-N 3.3Å; E77-N79 PolarHBondContact O-N 2.95Å; E77-Y80 WeakPolarHBondContact O-CA 3.44Å; E77-Y80 WeakPolarHBondContact O-CB 3.39Å; E77-Y80 PolarHBondContact O-N 2.92Å; E77-W81 PolarHBondContact O-N 3.23Å
78	L	95.3	Very high	94.6	Very high	106 Å²	106	113.2 Å²	113.2	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-57.3	-43.6	176.8	179	60.3	0	0	0	111.7	D74 W81 I82	D74-L78 WeakPolarHBondContact O-CB 3.45Å; D74-L78 PolarHBondContact O-N 3.01Å; L78-W81 PolarHBondContact O-N 2.7Å; L78-I82 HydrophobicContact CD1-CD1 4.06Å; L78-I82 HydrophobicContact CD1-CG1 4.39Å; L78-I82 HydrophobicContact CG-CD1 3.94Å; L78-I82 WeakPolarHBondContact O-CB 3.35Å; L78-I82 WeakPolarHBondContact O-CD1 3.3Å; L78-I82 VanDerWaalsContact O-CG1 3.23Å; L78-I82 WeakPolarHBondContact O-CG1 3.32Å; L78-I82 PolarHBondContact O-N 3.21Å
79	N	96.8	Very high	93.7	Very high	70 Å²	70	109.4 Å²	109.4	37%	0.374	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-34.1	175.5	-81.9	-79.2	0	0	0	113	R75 E76 E77 R83	R75-N79 PolarHBondContact O-N 2.93Å; R75-N79 PolarHBondContact O-ND2 3.46Å; E76-N79 PolarHBondContact O-N 3.27Å; E77-N79 VanDerWaalsContact C-N 3.3Å; E77-N79 PolarHBondContact O-N 2.95Å; N79-R83 WeakPolarHBondContact O-CG 3.42Å; N79-R83 PolarHBondContact O-N 2.68Å; N79-R83 VanDerWaalsContact O-N 3.16Å
80	Y	96.5	Very high	92.4	Very high	130 Å²	130	105.1 Å²	105.1	51%	0.51	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-49.6	172.5	168	-95.1	0	0	0	111.4	E76 E77 I82 R83 R84	E76-Y80 WeakPolarHBondContact O-CB 3.26Å; E76-Y80 PolarHBondContact O-N 2.81Å; E77-Y80 WeakPolarHBondContact O-CA 3.44Å; E77-Y80 WeakPolarHBondContact O-CB 3.39Å; E77-Y80 PolarHBondContact O-N 2.92Å; Y80-I82 PolarHBondContact O-N 3.21Å; Y80-R83 PolarHBondContact O-N 2.97Å; Y80-R84 PolarHBondContact O-N 2.8Å
81	W	94.6	Very high	91.1	Very high	156 Å²	156	109.3 Å²	109.3	59%	0.591	52%	0.517	S	S	*	.	H	α-helix	trans	-63.5	-38.6	178.6	-72.4	114.3	0	0	0	112.8	E77 L78 R84 Y85	E77-W81 PolarHBondContact O-N 3.23Å; L78-W81 PolarHBondContact O-N 2.7Å; W81-R84 PolarHBondContact O-N 3.31Å; W81-Y85 WeakPolarHBondContact O-CB 3.33Å; W81-Y85 PolarHBondContact O-N 3.18Å
82	I	93.7	Very high	89.6	Confident	99 Å²	99	110.1 Å²	110.1	51%	0.508	52%	0.519	S	S	.	.	H	α-helix	trans	-60.7	-47.3	174.3	-71.9	165.1	0	0	0	111.3	L78 Y80 Y85 S86	L78-I82 HydrophobicContact CD1-CD1 4.06Å; L78-I82 HydrophobicContact CD1-CG1 4.39Å; L78-I82 HydrophobicContact CG-CD1 3.94Å; L78-I82 WeakPolarHBondContact O-CB 3.35Å; L78-I82 WeakPolarHBondContact O-CD1 3.3Å; L78-I82 VanDerWaalsContact O-CG1 3.23Å; L78-I82 WeakPolarHBondContact O-CG1 3.32Å; L78-I82 PolarHBondContact O-N 3.21Å; Y80-I82 PolarHBondContact O-N 3.21Å; I82-Y85 PolarHBondContact O-N 3.48Å; I82-S86 PolarHBondContact O-N 3.44Å; I82-S86 VanDerWaalsContact O-N 3.09Å
83	R	95.3	Very high	87.7	Confident	151 Å²	151	114.1 Å²	114.1	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-60.7	-51.9	176.2	-70	-172.1	-153.9	96.9	-2.7	111.2	N79 Y80 Y85 S86 D87	N79-R83 WeakPolarHBondContact O-CG 3.42Å; N79-R83 PolarHBondContact O-N 2.68Å; N79-R83 VanDerWaalsContact O-N 3.16Å; Y80-R83 PolarHBondContact O-N 2.97Å; R83-Y85 PolarHBondContact O-N 3.49Å; R83-S86 WeakPolarHBondContact O-CA 3.41Å; R83-S86 WeakPolarHBondContact O-CB 3.25Å; R83-S86 PolarHBondContact O-N 3.27Å; R83-D87 PolarHBondContact O-N 3.13Å
84	R	94	Very high	85.5	Confident	137 Å²	137	114.5 Å²	114.5	52%	0.517	54%	0.543	S	S	.	.	H	α-helix	trans	-58.3	-36.9	-179.2	-153.8	-50.4	-163.4	159.4	-3.4	111.3	Y80 W81 A88	Y80-R84 PolarHBondContact O-N 2.8Å; W81-R84 PolarHBondContact O-N 3.31Å; R84-A88 WeakPolarHBondContact O-CB 3.43Å; R84-A88 PolarHBondContact O-N 3.02Å; R84-A88 VanDerWaalsContact O-N 3.16Å
85	Y	85.8	Confident	83.1	Confident	162 Å²	162	112.9 Å²	112.9	64%	0.635	55%	0.554	S	S	*	*	H	α-helix	trans	-66.2	-44.1	175.3	-168.9	-87.7	0	0	0	111.9	W81 I82 R83 A88 E89	W81-Y85 WeakPolarHBondContact O-CB 3.33Å; W81-Y85 PolarHBondContact O-N 3.18Å; I82-Y85 PolarHBondContact O-N 3.48Å; R83-Y85 PolarHBondContact O-N 3.49Å; Y85-A88 PolarHBondContact O-N 2.67Å; Y85-E89 HydrophobicContact CD1-CG 4.46Å; Y85-E89 HydrophobicContact CE1-CG 3.92Å; Y85-E89 PolarHBondContact O-N 3.44Å
86	S	89.7	Confident	81	Confident	59 Å²	59	109.4 Å²	109.4	41%	0.413	56%	0.56	S	S	.	*	H	α-helix	trans	-59.5	-52.2	173.5	-159.9	0	0	0	0	111.3	I82 R83 A88 E89 D90	I82-S86 PolarHBondContact O-N 3.44Å; I82-S86 VanDerWaalsContact O-N 3.09Å; R83-S86 WeakPolarHBondContact O-CA 3.41Å; R83-S86 WeakPolarHBondContact O-CB 3.25Å; R83-S86 PolarHBondContact O-N 3.27Å; S86-A88 PolarHBondContact O-N 3Å; S86-A88 VanDerWaalsContact O-N 3.09Å; S86-E89 PolarHBondContact O-N 3.14Å; S86-D90 WeakPolarHBondContact O-CB 3.38Å; S86-D90 PolarHBondContact O-N 2.72Å; S86-D90 PolarHBondContact OG-OD2 3.09Å
87	D	89.4	Confident	78.7	Confident	104 Å²	104	109.4 Å²	109.4	56%	0.556	57%	0.574	S	S	*	*	H	α-helix	trans	-54.3	-34.9	-179	-61	-34.7	0	0	0	112	R83 L91	R83-D87 PolarHBondContact O-N 3.13Å; D87-L91 WeakPolarHBondContact O-CB 3.32Å; D87-L91 PolarHBondContact O-N 3.47Å
88	A	82.5	Confident	76.1	Confident	33 Å²	33	109.5 Å²	109.5	27%	0.273	59%	0.588	S	S	.	*	H	α-helix	trans	-75.4	-39.1	179.1	0	0	0	0	0	113.8	R84 Y85 S86 K92	R84-A88 WeakPolarHBondContact O-CB 3.43Å; R84-A88 PolarHBondContact O-N 3.02Å; R84-A88 VanDerWaalsContact O-N 3.16Å; Y85-A88 PolarHBondContact O-N 2.67Å; S86-A88 PolarHBondContact O-N 3Å; S86-A88 VanDerWaalsContact O-N 3.09Å; A88-K92 WeakPolarHBondContact O-CB 3.42Å; A88-K92 PolarHBondContact O-N 2.68Å
89	E	79.7	Confident	73.8	Confident	80 Å²	80	110 Å²	110	37%	0.374	60%	0.601	S	S	.	*	H	α-helix	trans	-74.1	-31.2	173.6	-72.3	-65.7	102.8	0	0	111.6	Y85 S86 K92 K93	Y85-E89 HydrophobicContact CD1-CG 4.46Å; Y85-E89 HydrophobicContact CE1-CG 3.92Å; Y85-E89 PolarHBondContact O-N 3.44Å; S86-E89 PolarHBondContact O-N 3.14Å; E89-K92 WeakPolarHBondContact O-CB 3.45Å; E89-K92 PolarHBondContact O-N 3.4Å; E89-K92 WeakPolarHBondContact OE1-CD 3.49Å; E89-K92 IonicContact OE1-NZ 2.86Å; E89-K92 PolarHBondContact OE1-NZ 3.14Å; E89-K92 IonicContact OE2-NZ 3.86Å; E89-K92 PolarHBondContact OE2-NZ 3.01Å; E89-K93 WeakPolarHBondContact O-CB 3.47Å; E89-K93 PolarHBondContact O-N 3.44Å
90	D	70.9	Confident	71.3	Confident	84 Å²	84	111.9 Å²	111.9	45%	0.449	62%	0.619	S	S	.	*	H	α-helix	trans	-69.6	-37.7	171.5	-78.3	-53.5	0	0	0	111.7	S86 K92 K93 G94	S86-D90 WeakPolarHBondContact O-CB 3.38Å; S86-D90 PolarHBondContact O-N 2.72Å; S86-D90 PolarHBondContact OG-OD2 3.09Å; D90-K92 PolarHBondContact O-N 3.41Å; D90-K93 CarbonylContact O-C 3.59Å; D90-K93 PolarHBondContact O-N 2.84Å; D90-G94 WeakPolarHBondContact O-CA 3.29Å; D90-G94 PolarHBondContact O-N 2.88Å
91	L	69.1	Low	68.5	Low	151 Å²	151	115.1 Å²	115.1	79%	0.791	64%	0.639	S	S	*	*	H	α-helix	trans	-63.1	-31.5	173.8	-154	73	0	0	0	112.6	D87 K93	D87-L91 WeakPolarHBondContact O-CB 3.32Å; D87-L91 PolarHBondContact O-N 3.47Å; L91-K93 VanDerWaalsContact C-N 3.32Å
92	K	65.9	Low	65.9	Low	152 Å²	152	112.3 Å²	112.3	66%	0.661	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-15.8	175.6	-179.1	-172.7	177.5	-165.7	0	113.2	A88 E89 D90	A88-K92 WeakPolarHBondContact O-CB 3.42Å; A88-K92 PolarHBondContact O-N 2.68Å; E89-K92 WeakPolarHBondContact O-CB 3.45Å; E89-K92 PolarHBondContact O-N 3.4Å; E89-K92 WeakPolarHBondContact OE1-CD 3.49Å; E89-K92 IonicContact OE1-NZ 2.86Å; E89-K92 PolarHBondContact OE1-NZ 3.14Å; E89-K92 IonicContact OE2-NZ 3.86Å; E89-K92 PolarHBondContact OE2-NZ 3.01Å; D90-K92 PolarHBondContact O-N 3.41Å
93	K	58.7	Low	63.4	Low	174 Å²	174	117.4 Å²	117.4	76%	0.757	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-25.8	-179	-167.9	177.6	-179.9	-175.5	0	113.4	E89 D90 L91 G95	E89-K93 WeakPolarHBondContact O-CB 3.47Å; E89-K93 PolarHBondContact O-N 3.44Å; D90-K93 CarbonylContact O-C 3.59Å; D90-K93 PolarHBondContact O-N 2.84Å; L91-K93 VanDerWaalsContact C-N 3.32Å; K93-G95 VanDerWaalsContact C-N 3.35Å; K93-G95 PolarHBondContact O-N 3.02Å
94	G	50.5	Low	60.8	Low	57 Å²	57	117 Å²	117	59%	0.588	66%	0.66	S	S	*	*			trans	-83.2	0.6	-174.3	0	0	0	0	0	115.6	D90 G96	D90-G94 WeakPolarHBondContact O-CA 3.29Å; D90-G94 PolarHBondContact O-N 2.88Å; G94-G96 PolarHBondContact O-N 3.28Å
95	G	47.2	Very low	57.9	Low	82 Å²	82	118.4 Å²	118.4	85%	0.845	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	9.4	179.6	0	0	0	0	0	116.4	K93	K93-G95 VanDerWaalsContact C-N 3.35Å; K93-G95 PolarHBondContact O-N 3.02Å
96	G	52.2	Low	55.7	Low	63 Å²	63	116.2 Å²	116.2	65%	0.649	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.5	67.2	-179.8	0	0	0	0	0	115.3	G94	G94-G96 PolarHBondContact O-N 3.28Å
97	S	49.2	Very low	54.4	Low	120 Å²	120	119.3 Å²	119.3	84%	0.839	70%	0.7	S	S	*	*			trans	-169	92.4	152.1	-86.1	0	0	0	0	113.6
98	S	41	Very low	51.8	Low	129 Å²	129	120.5 Å²	120.5	90%	0.902	71%	0.711	S	S	*	*			trans	-148.7	51.2	169.2	50	0	0	0	0	112.4
99	S	46.4	Very low	49.7	Very low	118 Å²	118	126 Å²	126	83%	0.825	74%	0.736	S	S	*	*			trans	-113.7	87.9	179.7	168.5	0	0	0	0	111.9
100	S	44.1	Very low	48.4	Very low	108 Å²	108	127 Å²	127	76%	0.755	75%	0.749	S	S	*	*			trans	-148.4	68.7	176.2	-76.6	0	0	0	0	113.2
101	H	39.3	Very low	46.7	Very low	199 Å²	199	130.2 Å²	130.2	92%	0.921	77%	0.766	S	S	*	*			trans	177.4	145	147.7	-80.6	-24.8	0	0	0	109.1
102	S	39	Very low	45.9	Very low	96 Å²	96	128.2 Å²	128.2	67%	0.671	76%	0.762	S	S	*	*			cis	177.7	115	-32.5	175	0	0	0	0	107.4
103	R	41.5	Very low	44.5	Very low	206 Å²	206	128.2 Å²	128.2	78%	0.777	77%	0.774	S	S	*	*			trans	74.4	119	161.4	-66.1	-179.7	171.6	-137	-2.7	122.2
104	Q	40.4	Very low	43.6	Very low	142 Å²	142	124.5 Å²	124.5	66%	0.664	78%	0.776	S	S	*	*			trans	74.1	146.4	130.3	-65.1	176.5	11.7	0	0	118.3
105	Q	33.8	Very low	43.2	Very low	167 Å²	167	129.9 Å²	129.9	78%	0.78	79%	0.791	S	S	*	*			cis	-145.1	-174.9	8.6	-124.5	161.3	74.3	0	0	110.9
106	S	39.2	Very low	42.6	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	79%	0.788	S	S	*	*			trans	-108.6	-150.5	-159.4	-51	0	0	0	0	116
107	P	62.3	Low	42.2	Very low	123 Å²	123	134.5 Å²	134.5	80%	0.799	80%	0.795	S	S	*	*				-130.1	169.1	-113.9	40.5	-21.9	0	0	0	117.3
108	V	35.1	Very low	41.8	Very low	130 Å²	130	136.7 Å²	136.7	79%	0.788	79%	0.791	S	S	*	*			trans	-157.3	130	160.9	92.4	0	0	0	0	116.7
109	N	38.7	Very low	41.7	Very low	149 Å²	149	142 Å²	142	80%	0.797	79%	0.792	S	S	*	*			trans	48.2	157.2	151.8	-81	-40.8	0	0	0	125.8
110	P	51.8	Low	41.2	Very low	99 Å²	99	143.3 Å²	143.3	64%	0.643	79%	0.785	S	S	*	*			trans	-93.4	-170.9	-178	45	-40.8	0	0	0	112
111	D	35.6	Very low	41	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	79%	0.788	S	S	*	*			cis	-155.8	179.6	35.9	-120.1	-17.9	0	0	0	112.1
112	P	53.1	Low	41.2	Very low	110 Å²	110	144.5 Å²	144.5	71%	0.714	78%	0.78	S	S	*	*			trans	-96.3	165.8	-156.6	38.4	-40.7	0	0	0	117.1
113	V	36.3	Very low	41.4	Very low	151 Å²	151	147.6 Å²	147.6	92%	0.915	78%	0.783	S	S	*	*			trans	-140.7	138.4	153.6	-95.1	0	0	0	0	109.9
114	A	40	Very low	41.2	Very low	97 Å²	97	148.4 Å²	148.4	80%	0.802	79%	0.787	S	S	*	*			trans	-119.5	113.1	-178.3	0	0	0	0	0	111.4
115	L	40.6	Very low	41.5	Very low	169 Å²	169	147.4 Å²	147.4	89%	0.885	79%	0.792	S	S	*	*			trans	-156.7	144.8	169.5	-72.8	178.6	0	0	0	107.4
116	D	34.8	Very low	42.2	Very low	146 Å²	146	143.9 Å²	143.9	78%	0.781	79%	0.792	S	S	*	*			cis	-150.9	156.1	-24.7	-169.3	9.1	0	0	0	107.6	H118	D116-H118 PolarHBondContact O-N 2.75Å
117	A	44.7	Very low	42.8	Very low	97 Å²	97	144.2 Å²	144.2	80%	0.802	79%	0.794	S	S	*	*			trans	-85.1	76.6	-166.8	0	0	0	0	0	113.3
118	H	40.8	Very low	42.4	Very low	165 Å²	165	141.9 Å²	141.9	76%	0.764	79%	0.792	S	S	*	*			trans	-126.1	81.6	175.8	-144.3	-87.9	0	0	0	114.2	D116	D116-H118 PolarHBondContact O-N 2.75Å
119	R	38.3	Very low	43.3	Very low	242 Å²	242	143.8 Å²	143.8	91%	0.913	79%	0.786	S	S	*	*			trans	-137.6	71.6	163.9	-162.5	170.6	-174	166.4	2.6	112.6
120	E	36	Very low	44.6	Very low	144 Å²	144	140.9 Å²	140.9	67%	0.673	77%	0.774	S	S	*	*			trans	24.3	114.8	150.4	-60.7	-179.3	131.3	0	0	118.4	L122	E120-L122 HydrophobicContact CB-CG 4.45Å; E120-L122 PolarHBondContact O-N 3.37Å
121	F	40.3	Very low	45.7	Very low	190 Å²	190	139.7 Å²	139.7	83%	0.833	77%	0.766	S	S	*	*			trans	-75.1	54.6	178.9	-143	-93.8	0	0	0	113	H123	F121-H123 AromaticContact CD1-CD2 3.79Å; F121-H123 AromaticContact CE1-CD2 3.56Å; F121-H123 AromaticContact CE1-NE2 3.59Å; F121-H123 PolarHBondContact O-N 2.92Å; F121-H123 VanDerWaalsContact O-N 3.12Å
122	L	42.6	Very low	47.7	Very low	143 Å²	143	139.1 Å²	139.1	75%	0.749	76%	0.758	S	S	*	*			trans	-80.9	90.3	175.8	-70.1	-179.6	0	0	0	110.8	E120 R124	E120-L122 HydrophobicContact CB-CG 4.45Å; E120-L122 PolarHBondContact O-N 3.37Å; L122-R124 PolarHBondContact O-N 3.13Å
123	H	43.4	Very low	49	Very low	160 Å²	160	139 Å²	139	74%	0.741	75%	0.748	S	S	*	*			trans	-61.2	81.1	158.4	-93.6	-90.4	0	0	0	109.9	F121 P125	F121-H123 AromaticContact CD1-CD2 3.79Å; F121-H123 AromaticContact CE1-CD2 3.56Å; F121-H123 AromaticContact CE1-NE2 3.59Å; F121-H123 PolarHBondContact O-N 2.92Å; F121-H123 VanDerWaalsContact O-N 3.12Å; H123-P125 WeakPolarHBondContact O-CD 3.5Å
124	R	38.5	Very low	51.3	Low	224 Å²	224	136.6 Å²	136.6	85%	0.845	73%	0.729	S	S	*	*			trans	-65.5	122	169.1	-171.6	176.3	-165.9	164	6	108	L122 A126	L122-R124 PolarHBondContact O-N 3.13Å; R124-A126 PolarHBondContact O-N 3.39Å; R124-A126 VanDerWaalsContact O-N 3.08Å
125	P	45.5	Very low	53.4	Low	121 Å²	121	140.6 Å²	140.6	79%	0.786	72%	0.724	S	S	*	*			trans	-58.7	117.7	169.6	-22	34.1	0	0	0	108.5	H123 S127	H123-P125 WeakPolarHBondContact O-CD 3.5Å; P125-S127 PolarHBondContact O-N 3.34Å; P125-S127 VanDerWaalsContact O-N 3.13Å
126	A	48.6	Very low	55.8	Low	93 Å²	93	137.4 Å²	137.4	77%	0.769	70%	0.703	S	S	*	*			trans	-68	112.8	-177.7	0	0	0	0	0	109.3	R124 G128	R124-A126 PolarHBondContact O-N 3.39Å; R124-A126 VanDerWaalsContact O-N 3.08Å; A126-G128 PolarHBondContact O-N 3.2Å; A126-G128 VanDerWaalsContact O-N 3.17Å
127	S	52.7	Low	58.5	Low	124 Å²	124	136.5 Å²	136.5	87%	0.867	69%	0.692	S	S	*	*			trans	-62.6	114.4	-174	175.5	0	0	0	0	112.2	P125 Y129	P125-S127 PolarHBondContact O-N 3.34Å; P125-S127 VanDerWaalsContact O-N 3.13Å; S127-Y129 VanDerWaalsContact C-N 3.31Å; S127-Y129 PolarHBondContact O-N 3.13Å; S127-Y129 VanDerWaalsContact O-N 3.1Å
128	G	53.3	Low	60.8	Low	73 Å²	73	134.4 Å²	134.4	75%	0.753	67%	0.674	S	S	*	*	S	Bend	trans	72.5	3.1	152.2	0	0	0	0	0	118.3	A126 V130	A126-G128 PolarHBondContact O-N 3.2Å; A126-G128 VanDerWaalsContact O-N 3.17Å; G128-V130 PolarHBondContact O-N 2.79Å; G128-V130 VanDerWaalsContact O-N 3.1Å
129	Y	54.8	Low	63.3	Low	170 Å²	170	131.5 Å²	131.5	67%	0.667	66%	0.661	S	S	*	*			trans	-74.5	103.4	174.5	-163.4	-98.9	0	0	0	110.2	S127 P131	S127-Y129 VanDerWaalsContact C-N 3.31Å; S127-Y129 PolarHBondContact O-N 3.13Å; S127-Y129 VanDerWaalsContact O-N 3.1Å; Y129-P131 WeakPolarHBondContact O-CD 3.49Å
130	V	64.3	Low	66	Low	89 Å²	89	124.9 Å²	124.9	54%	0.539	64%	0.641	S	S	.	*			trans	-61.1	125.2	170.4	175.5	0	0	0	0	107.9	G128 E132 I134	G128-V130 PolarHBondContact O-N 2.79Å; G128-V130 VanDerWaalsContact O-N 3.1Å; V130-E132 PolarHBondContact O-N 2.92Å; V130-I134 HydrophobicContact CG1-CB 3.92Å; V130-I134 HydrophobicContact CG1-CD1 4.43Å; V130-I134 HydrophobicContact CG1-CG2 4.01Å
131	P	76.6	Confident	68.8	Low	74 Å²	74	120.7 Å²	120.7	48%	0.481	63%	0.63	S	S	.	*			trans	-51.9	135.7	-179.5	-29.9	34.9	0	0	0	112.9	Y129 E133 I134 W135	Y129-P131 WeakPolarHBondContact O-CD 3.49Å; P131-E133 PolarHBondContact O-N 2.93Å; P131-E133 VanDerWaalsContact O-N 3.14Å; P131-I134 HydrophobicContact CB-CD1 4.43Å; P131-I134 HydrophobicContact CB-CG1 4.37Å; P131-I134 HydrophobicContact CG-CD1 4.31Å; P131-I134 WeakPolarHBondContact O-CB 3.41Å; P131-I134 PolarHBondContact O-N 2.87Å; P131-W135 PolarHBondContact O-N 3.15Å
132	E	75.7	Confident	71.5	Confident	139 Å²	139	116.2 Å²	116.2	65%	0.65	62%	0.619	S	S	*	*	H	α-helix	trans	-55.9	-34.1	-174.5	-163.7	168.7	-176.9	0	0	112.5	V130 I134 W135 K136	V130-E132 PolarHBondContact O-N 2.92Å; E132-I134 VanDerWaalsContact C-N 3.27Å; E132-I134 PolarHBondContact O-N 2.94Å; E132-W135 PolarHBondContact O-N 3.46Å; E132-K136 WeakPolarHBondContact O-CB 3.22Å; E132-K136 PolarHBondContact O-N 3.14Å
133	E	80.6	Confident	74.1	Confident	108 Å²	108	113.1 Å²	113.1	51%	0.505	60%	0.603	S	S	.	*	H	α-helix	trans	-59.8	-27.8	172	-67.1	-60.8	139.1	0	0	114.8	P131 K137	P131-E133 PolarHBondContact O-N 2.93Å; P131-E133 VanDerWaalsContact O-N 3.14Å; E133-K137 WeakPolarHBondContact O-CB 3.39Å; E133-K137 VanDerWaalsContact O-CD 3.3Å; E133-K137 WeakPolarHBondContact O-CD 3.39Å; E133-K137 WeakPolarHBondContact O-CG 3.44Å; E133-K137 PolarHBondContact O-N 2.66Å
134	I	84.8	Confident	76.6	Confident	100 Å²	100	110.1 Å²	110.1	51%	0.513	59%	0.589	S	S	.	*	H	α-helix	trans	-80.4	-41	176	-59.3	-178.7	0	0	0	109.8	V130 P131 E132 K137 A138	V130-I134 HydrophobicContact CG1-CB 3.92Å; V130-I134 HydrophobicContact CG1-CD1 4.43Å; V130-I134 HydrophobicContact CG1-CG2 4.01Å; P131-I134 HydrophobicContact CB-CD1 4.43Å; P131-I134 HydrophobicContact CB-CG1 4.37Å; P131-I134 HydrophobicContact CG-CD1 4.31Å; P131-I134 WeakPolarHBondContact O-CB 3.41Å; P131-I134 PolarHBondContact O-N 2.87Å; E132-I134 VanDerWaalsContact C-N 3.27Å; E132-I134 PolarHBondContact O-N 2.94Å; I134-K137 PolarHBondContact O-N 2.92Å; I134-A138 PolarHBondContact O-N 2.87Å
135	W	84.4	Confident	79.5	Confident	181 Å²	181	104.5 Å²	104.5	69%	0.686	58%	0.579	S	S	*	*	H	α-helix	trans	-60.8	-49.9	174	-179.3	-92.9	0	0	0	111.1	P131 E132 K137 A138 E139	P131-W135 PolarHBondContact O-N 3.15Å; E132-W135 PolarHBondContact O-N 3.46Å; W135-K137 VanDerWaalsContact C-N 3.34Å; W135-K137 PolarHBondContact O-N 3.27Å; W135-A138 WeakPolarHBondContact O-CB 3.32Å; W135-A138 PolarHBondContact O-N 3.02Å; W135-E139 PolarHBondContact NE1-OE2 2.88Å; W135-E139 PolarHBondContact O-N 2.85Å
136	K	91.6	Very high	81.9	Confident	103 Å²	103	104.4 Å²	104.4	45%	0.448	57%	0.567	S	S	.	*	H	α-helix	trans	-55.9	-44.3	177.1	-178.2	179.5	170.8	-171.9	0	112.5	E132 A138 E139 E140	E132-K136 WeakPolarHBondContact O-CB 3.22Å; E132-K136 PolarHBondContact O-N 3.14Å; K136-A138 VanDerWaalsContact C-N 3.35Å; K136-A138 PolarHBondContact O-N 3.24Å; K136-E139 PolarHBondContact O-N 3.41Å; K136-E140 WeakPolarHBondContact CE-OE1 3.34Å; K136-E140 HydrophobicContact CG-CG 4.5Å; K136-E140 WeakPolarHBondContact O-CB 3.36Å; K136-E140 WeakPolarHBondContact O-CG 3.34Å; K136-E140 PolarHBondContact O-N 2.89Å
137	K	91.7	Very high	84.3	Confident	127 Å²	127	104.6 Å²	104.6	55%	0.552	55%	0.548	S	S	*	.	H	α-helix	trans	-66.2	-33.8	176.3	-75.6	169	-171.5	169.4	0	113.2	E133 I134 W135 A141	E133-K137 WeakPolarHBondContact O-CB 3.39Å; E133-K137 VanDerWaalsContact O-CD 3.3Å; E133-K137 WeakPolarHBondContact O-CD 3.39Å; E133-K137 WeakPolarHBondContact O-CG 3.44Å; E133-K137 PolarHBondContact O-N 2.66Å; I134-K137 PolarHBondContact O-N 2.92Å; W135-K137 VanDerWaalsContact C-N 3.34Å; W135-K137 PolarHBondContact O-N 3.27Å; K137-A141 WeakPolarHBondContact O-CB 3.25Å; K137-A141 PolarHBondContact O-N 3.45Å
138	A	93.5	Very high	86.5	Confident	52 Å²	52	102.5 Å²	102.5	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-67.7	-41.5	172.7	0	0	0	0	0	111.3	I134 W135 K136 A141 V142	I134-A138 PolarHBondContact O-N 2.87Å; W135-A138 WeakPolarHBondContact O-CB 3.32Å; W135-A138 PolarHBondContact O-N 3.02Å; K136-A138 VanDerWaalsContact C-N 3.35Å; K136-A138 PolarHBondContact O-N 3.24Å; A138-A141 PolarHBondContact O-N 3.19Å; A138-V142 WeakPolarHBondContact O-CB 3.33Å; A138-V142 VanDerWaalsContact O-CG2 3.31Å; A138-V142 WeakPolarHBondContact O-CG2 3.3Å; A138-V142 PolarHBondContact O-N 2.97Å
139	E	92.1	Very high	88.6	Confident	104 Å²	104	101.8 Å²	101.8	49%	0.486	51%	0.511	S	S	.	.	H	α-helix	trans	-67.1	-41.3	176.1	-178.3	163.7	-163.8	0	0	112.6	W135 K136 V142 N143	W135-E139 PolarHBondContact NE1-OE2 2.88Å; W135-E139 PolarHBondContact O-N 2.85Å; K136-E139 PolarHBondContact O-N 3.41Å; E139-V142 PolarHBondContact O-N 3.47Å; E139-N143 WeakPolarHBondContact CG-ND2 3.12Å; E139-N143 WeakPolarHBondContact O-CB 3.49Å; E139-N143 PolarHBondContact O-N 3.19Å; E139-N143 PolarHBondContact O-ND2 3.2Å
140	E	94.3	Very high	90.6	Very high	104 Å²	104	98.7 Å²	98.7	49%	0.486	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-45.5	171.8	-74.9	169.9	176.2	0	0	111.2	K136 N143 E144	K136-E140 WeakPolarHBondContact CE-OE1 3.34Å; K136-E140 HydrophobicContact CG-CG 4.5Å; K136-E140 WeakPolarHBondContact O-CB 3.36Å; K136-E140 WeakPolarHBondContact O-CG 3.34Å; K136-E140 PolarHBondContact O-N 2.89Å; E140-N143 PolarHBondContact O-N 2.86Å; E140-E144 WeakPolarHBondContact O-CB 3.21Å; E140-E144 PolarHBondContact O-N 3.39Å
141	A	95.9	Very high	92.2	Very high	55 Å²	55	97.2 Å²	97.2	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-40.6	176.5	0	0	0	0	0	112.9	K137 A138 E144 V145	K137-A141 WeakPolarHBondContact O-CB 3.25Å; K137-A141 PolarHBondContact O-N 3.45Å; A138-A141 PolarHBondContact O-N 3.19Å; A141-E144 PolarHBondContact O-N 3.49Å; A141-V145 WeakPolarHBondContact O-CG2 3.35Å; A141-V145 PolarHBondContact O-N 3.15Å
142	V	96.5	Very high	93.2	Very high	97 Å²	97	97.6 Å²	97.6	59%	0.588	49%	0.49	S	S	*	.	H	α-helix	trans	-65.2	-40.7	175.1	166.9	0	0	0	0	111.3	A138 E139 V145 K146	A138-V142 WeakPolarHBondContact O-CB 3.33Å; A138-V142 VanDerWaalsContact O-CG2 3.31Å; A138-V142 WeakPolarHBondContact O-CG2 3.3Å; A138-V142 PolarHBondContact O-N 2.97Å; E139-V142 PolarHBondContact O-N 3.47Å; V142-V145 PolarHBondContact O-N 3.25Å; V142-K146 VanDerWaalsContact O-CB 3.31Å; V142-K146 WeakPolarHBondContact O-CB 3.3Å; V142-K146 PolarHBondContact O-N 2.9Å
143	N	97.3	Very high	94.3	Very high	78 Å²	78	96.5 Å²	96.5	42%	0.417	49%	0.488	S	S	.	.	H	α-helix	trans	-67.1	-36	176.4	-79.6	-58.3	0	0	0	112.4	E139 E140 K146 R147	E139-N143 WeakPolarHBondContact CG-ND2 3.12Å; E139-N143 WeakPolarHBondContact O-CB 3.49Å; E139-N143 PolarHBondContact O-N 3.19Å; E139-N143 PolarHBondContact O-ND2 3.2Å; E140-N143 PolarHBondContact O-N 2.86Å; N143-K146 WeakPolarHBondContact O-CB 3.36Å; N143-K146 PolarHBondContact O-N 3.32Å; N143-R147 WeakPolarHBondContact O-CB 3.42Å; N143-R147 PolarHBondContact O-N 3.43Å
144	E	97.1	Very high	95.1	Very high	97 Å²	97	98 Å²	98	45%	0.453	50%	0.496	S	S	.	.	H	α-helix	trans	-69.4	-41.9	174.3	177.6	58.6	-172.6	0	0	112.2	E140 A141 K146 R147 Q148	E140-E144 WeakPolarHBondContact O-CB 3.21Å; E140-E144 PolarHBondContact O-N 3.39Å; A141-E144 PolarHBondContact O-N 3.49Å; E144-K146 VanDerWaalsContact C-N 3.31Å; E144-K146 PolarHBondContact O-N 2.91Å; E144-R147 WeakPolarHBondContact O-CB 3.42Å; E144-R147 PolarHBondContact O-N 3.39Å; E144-R147 IonicContact OE1-CZ 3.52Å; E144-R147 IonicContact OE1-NE 3.55Å; E144-R147 PolarHBondContact OE1-NE 2.97Å; E144-R147 IonicContact OE1-NH2 2.75Å; E144-R147 PolarHBondContact OE1-NH2 3.46Å; E144-R147 IonicContact OE2-CZ 3.56Å; E144-R147 IonicContact OE2-NE 2.65Å; E144-R147 PolarHBondContact OE2-NE 2.87Å; E144-R147 IonicContact OE2-NH2 3.92Å; E144-Q148 PolarHBondContact O-N 2.78Å
145	V	97.8	Very high	95.8	Very high	105 Å²	105	98.9 Å²	98.9	64%	0.636	50%	0.496	S	S	*	.	H	α-helix	trans	-60.4	-42.1	171.4	169.4	0	0	0	0	110.9	A141 V142 Q148 A149	A141-V145 WeakPolarHBondContact O-CG2 3.35Å; A141-V145 PolarHBondContact O-N 3.15Å; V142-V145 PolarHBondContact O-N 3.25Å; V145-Q148 PolarHBondContact O-N 2.9Å; V145-A149 VanDerWaalsContact O-CB 3.32Å; V145-A149 WeakPolarHBondContact O-CB 3.25Å; V145-A149 PolarHBondContact O-N 2.89Å
146	K	97.5	Very high	96.4	Very high	120 Å²	120	93 Å²	93	52%	0.522	49%	0.486	S	S	.	.	H	α-helix	trans	-61.6	-45.4	174.3	-176.3	-173.8	176.1	-175.5	0	111.5	V142 N143 E144 Q148 A149 M150	V142-K146 VanDerWaalsContact O-CB 3.31Å; V142-K146 WeakPolarHBondContact O-CB 3.3Å; V142-K146 PolarHBondContact O-N 2.9Å; N143-K146 WeakPolarHBondContact O-CB 3.36Å; N143-K146 PolarHBondContact O-N 3.32Å; E144-K146 VanDerWaalsContact C-N 3.31Å; E144-K146 PolarHBondContact O-N 2.91Å; K146-Q148 PolarHBondContact O-N 2.95Å; K146-A149 PolarHBondContact O-N 3.34Å; K146-M150 HydrophobicContact CG-CE 4.12Å; K146-M150 HydrophobicContact CG-SD 4.36Å; K146-M150 VanDerWaalsContact O-CG 3.31Å; K146-M150 WeakPolarHBondContact O-CG 3.47Å; K146-M150 PolarHBondContact O-N 3.29Å
147	R	98.1	Very high	96.7	Very high	97 Å²	97	91.1 Å²	91.1	37%	0.366	48%	0.483	S	S	.	.	H	α-helix	trans	-59	-45.9	175.9	-170.3	-155.7	59.3	60.4	3.7	111.1	N143 E144 M150 T151	N143-R147 WeakPolarHBondContact O-CB 3.42Å; N143-R147 PolarHBondContact O-N 3.43Å; E144-R147 WeakPolarHBondContact O-CB 3.42Å; E144-R147 PolarHBondContact O-N 3.39Å; E144-R147 IonicContact OE1-CZ 3.52Å; E144-R147 IonicContact OE1-NE 3.55Å; E144-R147 PolarHBondContact OE1-NE 2.97Å; E144-R147 IonicContact OE1-NH2 2.75Å; E144-R147 PolarHBondContact OE1-NH2 3.46Å; E144-R147 IonicContact OE2-CZ 3.56Å; E144-R147 IonicContact OE2-NE 2.65Å; E144-R147 PolarHBondContact OE2-NE 2.87Å; E144-R147 IonicContact OE2-NH2 3.92Å; R147-M150 PolarHBondContact O-N 2.62Å; R147-T151 PolarHBondContact NH1-OG1 3.05Å; R147-T151 WeakPolarHBondContact O-CB 3.38Å; R147-T151 PolarHBondContact O-N 2.96Å; R147-T151 PolarHBondContact O-OG1 3.31Å
148	Q	97.8	Very high	97.1	Very high	79 Å²	79	87.9 Å²	87.9	37%	0.369	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-41.6	179.4	-167.5	60	28.2	0	0	112	E144 V145 K146 M150 T151 E152	E144-Q148 PolarHBondContact O-N 2.78Å; V145-Q148 PolarHBondContact O-N 2.9Å; K146-Q148 PolarHBondContact O-N 2.95Å; Q148-M150 PolarHBondContact O-N 2.96Å; Q148-T151 WeakPolarHBondContact O-CB 3.49Å; Q148-T151 PolarHBondContact O-N 3.31Å; Q148-E152 PolarHBondContact NE2-OE1 3.42Å; Q148-E152 PolarHBondContact O-N 3.4Å
149	A	97.6	Very high	97.3	Very high	59 Å²	59	90.8 Å²	90.8	49%	0.488	48%	0.481	S	S	.	.	H	α-helix	trans	-62	-42.3	176	0	0	0	0	0	112.4	V145 K146 T151 L153	V145-A149 VanDerWaalsContact O-CB 3.32Å; V145-A149 WeakPolarHBondContact O-CB 3.25Å; V145-A149 PolarHBondContact O-N 2.89Å; K146-A149 PolarHBondContact O-N 3.34Å; A149-T151 VanDerWaalsContact C-N 3.33Å; A149-T151 PolarHBondContact O-N 2.96Å; A149-L153 VanDerWaalsContact O-CB 3.25Å; A149-L153 WeakPolarHBondContact O-CB 3.5Å; A149-L153 PolarHBondContact O-N 3.48Å
150	M	97.9	Very high	97.6	Very high	104 Å²	104	88.6 Å²	88.6	51%	0.512	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-37.5	173.5	-68.3	-177.4	-54.2	0	0	111.9	K146 R147 Q148 Q154	K146-M150 HydrophobicContact CG-CE 4.12Å; K146-M150 HydrophobicContact CG-SD 4.36Å; K146-M150 VanDerWaalsContact O-CG 3.31Å; K146-M150 WeakPolarHBondContact O-CG 3.47Å; K146-M150 PolarHBondContact O-N 3.29Å; R147-M150 PolarHBondContact O-N 2.62Å; Q148-M150 PolarHBondContact O-N 2.96Å; M150-Q154 WeakPolarHBondContact O-CB 3.42Å; M150-Q154 PolarHBondContact O-N 2.9Å
151	T	97.8	Very high	97.8	Very high	58 Å²	58	88.6 Å²	88.6	36%	0.356	48%	0.48	S	S	.	.	H	α-helix	trans	-65.9	-47.9	178.6	-53.8	0	0	0	0	111.7	R147 Q148 A149 Q154 K155	R147-T151 PolarHBondContact NH1-OG1 3.05Å; R147-T151 WeakPolarHBondContact O-CB 3.38Å; R147-T151 PolarHBondContact O-N 2.96Å; R147-T151 PolarHBondContact O-OG1 3.31Å; Q148-T151 WeakPolarHBondContact O-CB 3.49Å; Q148-T151 PolarHBondContact O-N 3.31Å; A149-T151 VanDerWaalsContact C-N 3.33Å; A149-T151 PolarHBondContact O-N 2.96Å; T151-Q154 PolarHBondContact O-N 3.43Å; T151-K155 VanDerWaalsContact O-CB 3.29Å; T151-K155 WeakPolarHBondContact O-CB 3.42Å; T151-K155 PolarHBondContact O-N 3.35Å
152	E	98	Very high	97.9	Very high	82 Å²	82	92 Å²	92	38%	0.383	48%	0.482	S	S	.	.	H	α-helix	trans	-69.3	-35.3	177.8	-68.8	-61.6	138.2	0	0	112.2	Q148 K155 A156	Q148-E152 PolarHBondContact NE2-OE1 3.42Å; Q148-E152 PolarHBondContact O-N 3.4Å; E152-K155 VanDerWaalsContact CD-NZ 3.29Å; E152-K155 IonicContact OE1-NZ 2.75Å; E152-K155 PolarHBondContact OE1-NZ 3.37Å; E152-K155 VanDerWaalsContact OE1-NZ 3.1Å; E152-K155 IonicContact OE2-NZ 3.17Å; E152-K155 PolarHBondContact OE2-NZ 3.15Å; E152-A156 WeakPolarHBondContact O-CB 3.47Å; E152-A156 PolarHBondContact O-N 3.47Å
153	L	98.4	Very high	98	Very high	116 Å²	116	94.3 Å²	94.3	61%	0.607	48%	0.484	S	S	*	.	H	α-helix	trans	-62.2	-49.4	172.6	177.3	61.3	0	0	0	111.6	A149 K155 A156 V157	A149-L153 VanDerWaalsContact O-CB 3.25Å; A149-L153 WeakPolarHBondContact O-CB 3.5Å; A149-L153 PolarHBondContact O-N 3.48Å; L153-K155 VanDerWaalsContact C-N 3.32Å; L153-K155 PolarHBondContact O-N 2.89Å; L153-A156 PolarHBondContact O-N 3.35Å; L153-V157 HydrophobicContact CD1-CG2 4.26Å; L153-V157 WeakPolarHBondContact O-CG2 3.48Å; L153-V157 PolarHBondContact O-N 2.92Å
154	Q	98.1	Very high	98	Very high	141 Å²	141	92.5 Å²	92.5	66%	0.659	48%	0.479	S	S	*	.	H	α-helix	trans	-61	-42.6	179.3	-175.8	176.1	-2.4	0	0	111.5	M150 T151 V157 S158	M150-Q154 WeakPolarHBondContact O-CB 3.42Å; M150-Q154 PolarHBondContact O-N 2.9Å; T151-Q154 PolarHBondContact O-N 3.43Å; Q154-V157 PolarHBondContact O-N 3.36Å; Q154-S158 PolarHBondContact O-N 2.74Å; Q154-S158 PolarHBondContact O-OG 2.88Å
155	K	98.3	Very high	98.1	Very high	118 Å²	118	93.8 Å²	93.8	51%	0.513	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-45.1	174.3	172.1	-177.3	160.9	-153.5	0	112.4	T151 E152 L153 S158 E159	T151-K155 VanDerWaalsContact O-CB 3.29Å; T151-K155 WeakPolarHBondContact O-CB 3.42Å; T151-K155 PolarHBondContact O-N 3.35Å; E152-K155 VanDerWaalsContact CD-NZ 3.29Å; E152-K155 IonicContact OE1-NZ 2.75Å; E152-K155 PolarHBondContact OE1-NZ 3.37Å; E152-K155 VanDerWaalsContact OE1-NZ 3.1Å; E152-K155 IonicContact OE2-NZ 3.17Å; E152-K155 PolarHBondContact OE2-NZ 3.15Å; L153-K155 VanDerWaalsContact C-N 3.32Å; L153-K155 PolarHBondContact O-N 2.89Å; K155-S158 PolarHBondContact O-N 2.95Å; K155-E159 PolarHBondContact O-N 2.75Å
156	A	98	Very high	98.1	Very high	58 Å²	58	92.3 Å²	92.3	48%	0.479	47%	0.474	S	S	.	.	H	α-helix	trans	-65.8	-38.2	176.9	0	0	0	0	0	112.5	E152 L153 A160	E152-A156 WeakPolarHBondContact O-CB 3.47Å; E152-A156 PolarHBondContact O-N 3.47Å; L153-A156 PolarHBondContact O-N 3.35Å; A156-A160 WeakPolarHBondContact O-CB 3.46Å; A156-A160 PolarHBondContact O-N 3.34Å
157	V	98.3	Very high	98.1	Very high	63 Å²	63	92.1 Å²	92.1	38%	0.382	48%	0.476	S	S	.	.	H	α-helix	trans	-62.1	-52.6	173.2	168.8	0	0	0	0	110.4	L153 Q154 E159 A160 E161	L153-V157 HydrophobicContact CD1-CG2 4.26Å; L153-V157 WeakPolarHBondContact O-CG2 3.48Å; L153-V157 PolarHBondContact O-N 2.92Å; Q154-V157 PolarHBondContact O-N 3.36Å; V157-E159 VanDerWaalsContact C-N 3.28Å; V157-E159 PolarHBondContact O-N 3.44Å; V157-A160 CarbonylContact O-C 3.56Å; V157-A160 WeakPolarHBondContact O-CA 3.36Å; V157-A160 WeakPolarHBondContact O-CB 3.41Å; V157-A160 PolarHBondContact O-N 2.9Å; V157-E161 HydrophobicContact CG1-CG 4.14Å; V157-E161 WeakPolarHBondContact O-CG 3.35Å; V157-E161 PolarHBondContact O-N 3.32Å
158	S	98.3	Very high	98.1	Very high	59 Å²	59	92.5 Å²	92.5	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-65.6	-27.6	-179.8	-63.3	0	0	0	0	114.1	Q154 K155 E161 R162	Q154-S158 PolarHBondContact O-N 2.74Å; Q154-S158 PolarHBondContact O-OG 2.88Å; K155-S158 PolarHBondContact O-N 2.95Å; S158-E161 WeakPolarHBondContact CA-OE2 3.29Å; S158-R162 WeakPolarHBondContact O-CB 3.27Å; S158-R162 PolarHBondContact O-N 3.49Å
159	E	98.1	Very high	98.1	Very high	112 Å²	112	93 Å²	93	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-69.3	-42.3	169.1	-172.7	172.4	178.1	0	0	112.1	K155 V157 R162 K163	K155-E159 PolarHBondContact O-N 2.75Å; V157-E159 VanDerWaalsContact C-N 3.28Å; V157-E159 PolarHBondContact O-N 3.44Å; E159-R162 IonicContact OE1-NH2 2.69Å; E159-K163 VanDerWaalsContact O-CB 3.27Å; E159-K163 WeakPolarHBondContact O-CB 3.33Å; E159-K163 PolarHBondContact O-N 3.36Å
160	A	98.3	Very high	98.1	Very high	59 Å²	59	93.6 Å²	93.6	49%	0.488	49%	0.49	S	S	.	.	H	α-helix	trans	-65.8	-42.7	176.6	0	0	0	0	0	112.3	A156 V157 K163 A164	A156-A160 WeakPolarHBondContact O-CB 3.46Å; A156-A160 PolarHBondContact O-N 3.34Å; V157-A160 CarbonylContact O-C 3.56Å; V157-A160 WeakPolarHBondContact O-CA 3.36Å; V157-A160 WeakPolarHBondContact O-CB 3.41Å; V157-A160 PolarHBondContact O-N 2.9Å; A160-K163 PolarHBondContact O-N 2.96Å; A160-A164 WeakPolarHBondContact O-CB 3.39Å; A160-A164 PolarHBondContact O-N 3.27Å
161	E	97.9	Very high	98.1	Very high	103 Å²	103	93 Å²	93	48%	0.481	49%	0.486	S	S	.	.	H	α-helix	trans	-58.4	-52.9	173.9	-71.9	171.7	150.6	0	0	110.9	V157 S158 K163 A164 H165	V157-E161 HydrophobicContact CG1-CG 4.14Å; V157-E161 WeakPolarHBondContact O-CG 3.35Å; V157-E161 PolarHBondContact O-N 3.32Å; S158-E161 WeakPolarHBondContact CA-OE2 3.29Å; E161-K163 VanDerWaalsContact C-N 3.34Å; E161-K163 PolarHBondContact O-N 2.83Å; E161-A164 WeakPolarHBondContact O-CB 3.33Å; E161-A164 PolarHBondContact O-N 2.88Å; E161-A164 VanDerWaalsContact O-N 3.16Å; E161-H165 PolarHBondContact O-CD2 3.13Å; E161-H165 PolarHBondContact O-N 3.02Å
162	R	98.3	Very high	98.1	Very high	127 Å²	127	98.7 Å²	98.7	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-56.6	-47.8	176.2	-177	-170.9	54.6	71	-2.3	111.1	S158 E159 A164 H165 D166	S158-R162 WeakPolarHBondContact O-CB 3.27Å; S158-R162 PolarHBondContact O-N 3.49Å; E159-R162 IonicContact OE1-NH2 2.69Å; R162-A164 VanDerWaalsContact C-N 3.29Å; R162-A164 PolarHBondContact O-N 3.03Å; R162-H165 PolarHBondContact O-N 2.93Å; R162-H165 VanDerWaalsContact O-N 3.13Å; R162-D166 IonicContact CZ-OD2 3.77Å; R162-D166 IonicContact NH1-OD2 2.68Å; R162-D166 PolarHBondContact NH1-OD2 2.98Å; R162-D166 PolarHBondContact O-N 3.16Å
163	K	98.4	Very high	98.2	Very high	146 Å²	146	96.8 Å²	96.8	64%	0.635	50%	0.499	S	S	*	.	H	α-helix	trans	-62	-35	179.2	-173	177.3	-179.9	179.7	0	112.5	E159 A160 E161 M167	E159-K163 VanDerWaalsContact O-CB 3.27Å; E159-K163 WeakPolarHBondContact O-CB 3.33Å; E159-K163 PolarHBondContact O-N 3.36Å; A160-K163 PolarHBondContact O-N 2.96Å; E161-K163 VanDerWaalsContact C-N 3.34Å; E161-K163 PolarHBondContact O-N 2.83Å; K163-M167 WeakPolarHBondContact O-CB 3.32Å; K163-M167 PolarHBondContact O-N 3.35Å
164	A	98.4	Very high	98.2	Very high	39 Å²	39	95.7 Å²	95.7	32%	0.322	49%	0.49	S	S	.	.	H	α-helix	trans	-68	-43.2	173	0	0	0	0	0	111.7	A160 E161 R162 M167 I168	A160-A164 WeakPolarHBondContact O-CB 3.39Å; A160-A164 PolarHBondContact O-N 3.27Å; E161-A164 WeakPolarHBondContact O-CB 3.33Å; E161-A164 PolarHBondContact O-N 2.88Å; E161-A164 VanDerWaalsContact O-N 3.16Å; R162-A164 VanDerWaalsContact C-N 3.29Å; R162-A164 PolarHBondContact O-N 3.03Å; A164-M167 PolarHBondContact O-N 2.73Å; A164-I168 WeakPolarHBondContact O-CB 3.33Å; A164-I168 WeakPolarHBondContact O-CD1 3.36Å; A164-I168 VanDerWaalsContact O-CG1 3.25Å; A164-I168 WeakPolarHBondContact O-CG1 3.48Å; A164-I168 PolarHBondContact O-N 2.82Å
165	H	98.3	Very high	98.1	Very high	124 Å²	124	94.7 Å²	94.7	57%	0.574	49%	0.487	S	S	*	.	H	α-helix	trans	-63.5	-42.3	174.2	-74.9	-64.9	0	0	0	112.9	E161 R162 M167 I168 T169	E161-H165 PolarHBondContact O-CD2 3.13Å; E161-H165 PolarHBondContact O-N 3.02Å; R162-H165 PolarHBondContact O-N 2.93Å; R162-H165 VanDerWaalsContact O-N 3.13Å; H165-M167 VanDerWaalsContact C-N 3.33Å; H165-M167 PolarHBondContact O-N 2.91Å; H165-I168 PolarHBondContact O-N 2.75Å; H165-T169 VanDerWaalsContact O-CB 3.29Å; H165-T169 WeakPolarHBondContact O-CB 3.37Å; H165-T169 PolarHBondContact O-N 2.79Å; H165-T169 PolarHBondContact O-OG1 2.7Å
166	D	97.9	Very high	98.1	Very high	74 Å²	74	94.6 Å²	94.6	40%	0.396	49%	0.488	S	S	.	.	H	α-helix	trans	-60.1	-43.2	175.2	-66.9	-28.6	0	0	0	110.8	R162 T170	R162-D166 IonicContact CZ-OD2 3.77Å; R162-D166 IonicContact NH1-OD2 2.68Å; R162-D166 PolarHBondContact NH1-OD2 2.98Å; R162-D166 PolarHBondContact O-N 3.16Å; D166-T170 WeakPolarHBondContact O-CB 3.25Å; D166-T170 PolarHBondContact O-N 3.24Å; D166-T170 PolarHBondContact O-OG1 3.43Å
167	M	97.7	Very high	98.1	Very high	116 Å²	116	99.1 Å²	99.1	57%	0.571	49%	0.493	S	S	*	.	H	α-helix	trans	-65.6	-49.6	176.5	-176.5	175.3	69	0	0	112.2	K163 A164 H165 T169 T170 E171	K163-M167 WeakPolarHBondContact O-CB 3.32Å; K163-M167 PolarHBondContact O-N 3.35Å; A164-M167 PolarHBondContact O-N 2.73Å; H165-M167 VanDerWaalsContact C-N 3.33Å; H165-M167 PolarHBondContact O-N 2.91Å; M167-T169 VanDerWaalsContact C-N 3.29Å; M167-T169 PolarHBondContact O-N 2.94Å; M167-T170 PolarHBondContact O-N 2.72Å; M167-T170 VanDerWaalsContact O-N 3.15Å; M167-E171 PolarHBondContact O-N 2.98Å
168	I	97.9	Very high	98.1	Very high	105 Å²	105	100 Å²	100	54%	0.538	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-42.1	177.9	-70.3	163.7	0	0	0	110.7	A164 H165 R172	A164-I168 WeakPolarHBondContact O-CB 3.33Å; A164-I168 WeakPolarHBondContact O-CD1 3.36Å; A164-I168 VanDerWaalsContact O-CG1 3.25Å; A164-I168 WeakPolarHBondContact O-CG1 3.48Å; A164-I168 PolarHBondContact O-N 2.82Å; H165-I168 PolarHBondContact O-N 2.75Å; I168-R172 VanDerWaalsContact O-CB 3.25Å; I168-R172 WeakPolarHBondContact O-CB 3.47Å; I168-R172 PolarHBondContact O-N 2.97Å
169	T	98.1	Very high	98	Very high	91 Å²	91	100.3 Å²	100.3	56%	0.558	50%	0.498	S	S	*	.	H	α-helix	trans	-65.2	-40.9	177.4	-55.6	0	0	0	0	111.2	H165 M167 A173	H165-T169 VanDerWaalsContact O-CB 3.29Å; H165-T169 WeakPolarHBondContact O-CB 3.37Å; H165-T169 PolarHBondContact O-N 2.79Å; H165-T169 PolarHBondContact O-OG1 2.7Å; M167-T169 VanDerWaalsContact C-N 3.29Å; M167-T169 PolarHBondContact O-N 2.94Å; T169-A173 VanDerWaalsContact O-CB 3.3Å; T169-A173 WeakPolarHBondContact O-CB 3.46Å; T169-A173 PolarHBondContact O-N 2.86Å
170	T	98.4	Very high	98	Very high	70 Å²	70	99 Å²	99	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-64.8	-46.8	177.1	-61	0	0	0	0	112	D166 M167 A173 K174	D166-T170 WeakPolarHBondContact O-CB 3.25Å; D166-T170 PolarHBondContact O-N 3.24Å; D166-T170 PolarHBondContact O-OG1 3.43Å; M167-T170 PolarHBondContact O-N 2.72Å; M167-T170 VanDerWaalsContact O-N 3.15Å; T170-A173 PolarHBondContact O-N 2.73Å; T170-K174 WeakPolarHBondContact O-CG 3.5Å; T170-K174 PolarHBondContact O-N 2.98Å
171	E	98.1	Very high	98	Very high	91 Å²	91	100.7 Å²	100.7	43%	0.425	50%	0.495	S	S	.	.	H	α-helix	trans	-68.5	-38.7	178	-62.8	-42	112.8	0	0	112	M167 A173 K174 M175	M167-E171 PolarHBondContact O-N 2.98Å; E171-A173 PolarHBondContact O-N 3.29Å; E171-K174 VanDerWaalsContact CD-NZ 3.31Å; E171-K174 WeakPolarHBondContact O-CB 3.32Å; E171-K174 PolarHBondContact O-N 2.93Å; E171-K174 WeakPolarHBondContact OE1-CE 3.46Å; E171-K174 IonicContact OE1-NZ 3.47Å; E171-K174 PolarHBondContact OE1-NZ 3.25Å; E171-K174 WeakPolarHBondContact OE2-CD 3.29Å; E171-K174 IonicContact OE2-NZ 3.1Å; E171-K174 PolarHBondContact OE2-NZ 3.37Å; E171-K174 VanDerWaalsContact OE2-NZ 3.14Å; E171-M175 WeakPolarHBondContact O-CB 3.29Å; E171-M175 PolarHBondContact O-N 2.9Å
172	R	98	Very high	97.9	Very high	179 Å²	179	98.8 Å²	98.8	68%	0.675	50%	0.497	S	S	*	.	H	α-helix	trans	-58.8	-47	171.6	-178.9	177.1	174.3	169.3	1.1	111.2	I168 K174 M175 E176	I168-R172 VanDerWaalsContact O-CB 3.25Å; I168-R172 WeakPolarHBondContact O-CB 3.47Å; I168-R172 PolarHBondContact O-N 2.97Å; R172-K174 VanDerWaalsContact C-N 3.28Å; R172-K174 PolarHBondContact O-N 3.39Å; R172-M175 PolarHBondContact O-N 3.36Å; R172-E176 WeakPolarHBondContact O-CB 3.34Å; R172-E176 PolarHBondContact O-N 3.43Å
173	A	98.3	Very high	97.9	Very high	41 Å²	41	99.7 Å²	99.7	34%	0.339	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-25.5	178.2	0	0	0	0	0	113.1	T169 T170 E171 R177	T169-A173 VanDerWaalsContact O-CB 3.3Å; T169-A173 WeakPolarHBondContact O-CB 3.46Å; T169-A173 PolarHBondContact O-N 2.86Å; T170-A173 PolarHBondContact O-N 2.73Å; E171-A173 PolarHBondContact O-N 3.29Å; A173-R177 WeakPolarHBondContact O-CG 3.27Å; A173-R177 PolarHBondContact O-N 3.26Å; A173-R177 PolarHBondContact O-NE 2.99Å; A173-R177 PolarHBondContact O-NH2 3.15Å
174	K	98.3	Very high	97.9	Very high	94 Å²	94	97.4 Å²	97.4	41%	0.409	49%	0.492	S	S	.	.	H	α-helix	trans	-72.2	-49.8	168.8	-72.1	169.8	-177.8	171.3	0	111.2	T170 E171 R172 E176 R177 T178	T170-K174 WeakPolarHBondContact O-CG 3.5Å; T170-K174 PolarHBondContact O-N 2.98Å; E171-K174 VanDerWaalsContact CD-NZ 3.31Å; E171-K174 WeakPolarHBondContact O-CB 3.32Å; E171-K174 PolarHBondContact O-N 2.93Å; E171-K174 WeakPolarHBondContact OE1-CE 3.46Å; E171-K174 IonicContact OE1-NZ 3.47Å; E171-K174 PolarHBondContact OE1-NZ 3.25Å; E171-K174 WeakPolarHBondContact OE2-CD 3.29Å; E171-K174 IonicContact OE2-NZ 3.1Å; E171-K174 PolarHBondContact OE2-NZ 3.37Å; E171-K174 VanDerWaalsContact OE2-NZ 3.14Å; R172-K174 VanDerWaalsContact C-N 3.28Å; R172-K174 PolarHBondContact O-N 3.39Å; K174-E176 VanDerWaalsContact C-N 3.32Å; K174-E176 PolarHBondContact O-N 2.92Å; K174-R177 WeakPolarHBondContact O-CB 3.43Å; K174-R177 PolarHBondContact O-N 2.93Å; K174-T178 PolarHBondContact O-N 3.46Å; K174-T178 PolarHBondContact O-OG1 2.83Å
175	M	97.9	Very high	97.8	Very high	120 Å²	120	99.1 Å²	99.1	59%	0.591	49%	0.493	S	S	*	.	H	α-helix	trans	-56.8	-46.3	179	179.1	58.1	69.2	0	0	111.3	E171 R172 R177 T178 V179	E171-M175 WeakPolarHBondContact O-CB 3.29Å; E171-M175 PolarHBondContact O-N 2.9Å; R172-M175 PolarHBondContact O-N 3.36Å; M175-R177 PolarHBondContact O-N 3.24Å; M175-T178 WeakPolarHBondContact CA-OG1 3.31Å; M175-T178 PolarHBondContact O-N 3.39Å; M175-T178 VanDerWaalsContact O-N 3.15Å; M175-T178 PolarHBondContact O-OG1 2.95Å; M175-V179 WeakPolarHBondContact O-CG2 3.36Å; M175-V179 PolarHBondContact O-N 3.03Å; M175-V179 HydrophobicContact SD-CG2 4.24Å
176	E	97.5	Very high	97.7	Very high	115 Å²	115	96 Å²	96	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-59.1	-44.7	177.6	-169.9	168	163	0	0	111.8	R172 K174 T178 V179 T180	R172-E176 WeakPolarHBondContact O-CB 3.34Å; R172-E176 PolarHBondContact O-N 3.43Å; K174-E176 VanDerWaalsContact C-N 3.32Å; K174-E176 PolarHBondContact O-N 2.92Å; E176-T178 PolarHBondContact O-N 2.67Å; E176-V179 PolarHBondContact O-N 3.04Å; E176-T180 PolarHBondContact O-N 3.07Å; E176-T180 PolarHBondContact O-OG1 2.81Å
177	R	97.7	Very high	97.6	Very high	153 Å²	153	95.1 Å²	95.1	58%	0.577	49%	0.492	S	S	*	.	H	α-helix	trans	-60.3	-43.6	172.8	-81.7	175.9	-73.6	166.3	-4.5	112.6	A173 K174 M175 V179 T180 E181	A173-R177 WeakPolarHBondContact O-CG 3.27Å; A173-R177 PolarHBondContact O-N 3.26Å; A173-R177 PolarHBondContact O-NE 2.99Å; A173-R177 PolarHBondContact O-NH2 3.15Å; K174-R177 WeakPolarHBondContact O-CB 3.43Å; K174-R177 PolarHBondContact O-N 2.93Å; M175-R177 PolarHBondContact O-N 3.24Å; R177-V179 VanDerWaalsContact C-N 3.3Å; R177-V179 PolarHBondContact O-N 3.32Å; R177-T180 WeakPolarHBondContact CA-OG1 3.31Å; R177-T180 PolarHBondContact O-N 3.48Å; R177-T180 PolarHBondContact O-OG1 3.29Å; R177-E181 VanDerWaalsContact O-CB 3.26Å; R177-E181 WeakPolarHBondContact O-CB 3.32Å; R177-E181 PolarHBondContact O-N 3.04Å
178	T	97.3	Very high	97.5	Very high	83 Å²	83	93.6 Å²	93.6	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-31.8	176.4	50.2	0	0	0	0	112.8	K174 M175 E176 A182	K174-T178 PolarHBondContact O-N 3.46Å; K174-T178 PolarHBondContact O-OG1 2.83Å; M175-T178 WeakPolarHBondContact CA-OG1 3.31Å; M175-T178 PolarHBondContact O-N 3.39Å; M175-T178 VanDerWaalsContact O-N 3.15Å; M175-T178 PolarHBondContact O-OG1 2.95Å; E176-T178 PolarHBondContact O-N 2.67Å; T178-A182 WeakPolarHBondContact O-CB 3.48Å; T178-A182 PolarHBondContact O-N 3.1Å
179	V	97.7	Very high	97.4	Very high	65 Å²	65	92.7 Å²	92.7	39%	0.394	48%	0.479	S	S	.	.	H	α-helix	trans	-73	-40	175.1	170.2	0	0	0	0	111.6	M175 E176 R177 E181 K183	M175-V179 WeakPolarHBondContact O-CG2 3.36Å; M175-V179 PolarHBondContact O-N 3.03Å; M175-V179 HydrophobicContact SD-CG2 4.24Å; E176-V179 PolarHBondContact O-N 3.04Å; R177-V179 VanDerWaalsContact C-N 3.3Å; R177-V179 PolarHBondContact O-N 3.32Å; V179-E181 VanDerWaalsContact C-N 3.33Å; V179-K183 HydrophobicContact CG1-CD 4.41Å; V179-K183 WeakPolarHBondContact O-CB 3.49Å; V179-K183 VanDerWaalsContact O-CG 3.29Å; V179-K183 WeakPolarHBondContact O-CG 3.31Å; V179-K183 PolarHBondContact O-N 3.19Å; V179-K183 VanDerWaalsContact O-N 3.13Å
180	T	97.6	Very high	97.2	Very high	84 Å²	84	90.8 Å²	90.8	52%	0.515	47%	0.473	S	S	.	.	H	α-helix	trans	-66.1	-37.4	173.1	50.3	0	0	0	0	111.9	E176 R177 K183 R184	E176-T180 PolarHBondContact O-N 3.07Å; E176-T180 PolarHBondContact O-OG1 2.81Å; R177-T180 WeakPolarHBondContact CA-OG1 3.31Å; R177-T180 PolarHBondContact O-N 3.48Å; R177-T180 PolarHBondContact O-OG1 3.29Å; T180-K183 PolarHBondContact O-N 3.06Å; T180-R184 PolarHBondContact O-N 2.92Å
181	E	97.4	Very high	96.9	Very high	95 Å²	95	93 Å²	93	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-69.1	-44.7	178.5	179.9	63.8	177.2	0	0	112	R177 V179 K183 R184 Q185	R177-E181 VanDerWaalsContact O-CB 3.26Å; R177-E181 WeakPolarHBondContact O-CB 3.32Å; R177-E181 PolarHBondContact O-N 3.04Å; V179-E181 VanDerWaalsContact C-N 3.33Å; E181-K183 VanDerWaalsContact C-N 3.26Å; E181-K183 PolarHBondContact O-N 3.19Å; E181-R184 WeakPolarHBondContact O-CB 3.48Å; E181-R184 PolarHBondContact O-N 3.18Å; E181-R184 VanDerWaalsContact O-N 3.15Å; E181-R184 IonicContact OE1-CZ 2.97Å; E181-R184 IonicContact OE1-NE 2.79Å; E181-R184 IonicContact OE1-NH2 3.01Å; E181-R184 PolarHBondContact OE1-NH2 2.96Å; E181-R184 IonicContact OE2-CZ 3.13Å; E181-R184 IonicContact OE2-NE 3.47Å; E181-R184 PolarHBondContact OE2-NE 3.5Å; E181-R184 IonicContact OE2-NH2 2.7Å; E181-R184 PolarHBondContact OE2-NH2 2.96Å; E181-Q185 PolarHBondContact O-N 3.4Å
182	A	97.6	Very high	96.7	Very high	63 Å²	63	90.8 Å²	90.8	52%	0.521	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-34.9	174.1	0	0	0	0	0	112.3	T178 A186	T178-A182 WeakPolarHBondContact O-CB 3.48Å; T178-A182 PolarHBondContact O-N 3.1Å; A182-A186 VanDerWaalsContact O-CB 3.3Å; A182-A186 WeakPolarHBondContact O-CB 3.48Å; A182-A186 PolarHBondContact O-N 2.93Å
183	K	97.4	Very high	96.3	Very high	146 Å²	146	86.7 Å²	86.7	64%	0.635	47%	0.474	S	S	*	.	H	α-helix	trans	-68.8	-40.2	172.9	-74.8	175	179.1	-176.3	0	112.7	V179 T180 E181 A187	V179-K183 HydrophobicContact CG1-CD 4.41Å; V179-K183 WeakPolarHBondContact O-CB 3.49Å; V179-K183 VanDerWaalsContact O-CG 3.29Å; V179-K183 WeakPolarHBondContact O-CG 3.31Å; V179-K183 PolarHBondContact O-N 3.19Å; V179-K183 VanDerWaalsContact O-N 3.13Å; T180-K183 PolarHBondContact O-N 3.06Å; E181-K183 VanDerWaalsContact C-N 3.26Å; E181-K183 PolarHBondContact O-N 3.19Å; K183-A187 PolarHBondContact O-N 3.49Å; K183-A187 VanDerWaalsContact O-N 3.13Å
184	R	97.6	Very high	95.7	Very high	97 Å²	97	89 Å²	89	37%	0.366	48%	0.48	S	S	.	.	H	α-helix	trans	-60.4	-50.8	173.8	-174.5	-168.7	67.7	71.7	12.1	110.2	T180 E181 A186 A187 E188	T180-R184 PolarHBondContact O-N 2.92Å; E181-R184 WeakPolarHBondContact O-CB 3.48Å; E181-R184 PolarHBondContact O-N 3.18Å; E181-R184 VanDerWaalsContact O-N 3.15Å; E181-R184 IonicContact OE1-CZ 2.97Å; E181-R184 IonicContact OE1-NE 2.79Å; E181-R184 IonicContact OE1-NH2 3.01Å; E181-R184 PolarHBondContact OE1-NH2 2.96Å; E181-R184 IonicContact OE2-CZ 3.13Å; E181-R184 IonicContact OE2-NE 3.47Å; E181-R184 PolarHBondContact OE2-NE 3.5Å; E181-R184 IonicContact OE2-NH2 2.7Å; E181-R184 PolarHBondContact OE2-NH2 2.96Å; R184-A186 PolarHBondContact O-N 3.17Å; R184-A187 PolarHBondContact O-N 3.48Å; R184-E188 WeakPolarHBondContact CG-OE1 3.43Å; R184-E188 IonicContact CZ-OE1 2.72Å; R184-E188 IonicContact CZ-OE2 2.67Å; R184-E188 IonicContact NH1-OE1 2.68Å; R184-E188 PolarHBondContact NH1-OE1 3.49Å; R184-E188 IonicContact NH1-OE2 2.7Å; R184-E188 PolarHBondContact NH1-OE2 3.04Å; R184-E188 PolarHBondContact O-N 2.94Å
185	Q	96.9	Very high	95	Very high	76 Å²	76	88.8 Å²	88.8	36%	0.355	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-45.7	179.6	-166.8	61.1	55.2	0	0	111.9	E181 A187 E188 D189	E181-Q185 PolarHBondContact O-N 3.4Å; Q185-A187 VanDerWaalsContact C-N 3.26Å; Q185-A187 PolarHBondContact O-N 3.5Å; Q185-E188 PolarHBondContact O-N 3.38Å; Q185-E188 VanDerWaalsContact O-N 3.13Å; Q185-D189 PolarHBondContact NE2-OD1 3.48Å; Q185-D189 WeakPolarHBondContact O-CB 3.43Å; Q185-D189 PolarHBondContact O-N 2.87Å
186	A	96.6	Very high	94.2	Very high	59 Å²	59	89.1 Å²	89.1	49%	0.488	48%	0.483	S	S	.	.	H	α-helix	trans	-62.2	-31.2	177.6	0	0	0	0	0	113.5	A182 R184 A190	A182-A186 VanDerWaalsContact O-CB 3.3Å; A182-A186 WeakPolarHBondContact O-CB 3.48Å; A182-A186 PolarHBondContact O-N 2.93Å; R184-A186 PolarHBondContact O-N 3.17Å; A186-A190 WeakPolarHBondContact O-CB 3.47Å; A186-A190 PolarHBondContact O-N 3Å
187	A	96.2	Very high	92.9	Very high	54 Å²	54	90 Å²	90	45%	0.446	49%	0.487	S	S	.	.	H	α-helix	trans	-73.1	-40.1	173.4	0	0	0	0	0	112.1	K183 R184 Q185 A190 L191	K183-A187 PolarHBondContact O-N 3.49Å; K183-A187 VanDerWaalsContact O-N 3.13Å; R184-A187 PolarHBondContact O-N 3.48Å; Q185-A187 VanDerWaalsContact C-N 3.26Å; Q185-A187 PolarHBondContact O-N 3.5Å; A187-A190 PolarHBondContact O-N 3.42Å; A187-L191 WeakPolarHBondContact O-CG 3.38Å; A187-L191 PolarHBondContact O-N 2.86Å
188	E	95.9	Very high	91.6	Very high	84 Å²	84	88.2 Å²	88.2	39%	0.393	49%	0.485	S	S	.	.	H	α-helix	trans	-68.3	-40	175.9	-74.5	171.7	-160.3	0	0	112.3	R184 Q185 A190 L191 A192	R184-E188 WeakPolarHBondContact CG-OE1 3.43Å; R184-E188 IonicContact CZ-OE1 2.72Å; R184-E188 IonicContact CZ-OE2 2.67Å; R184-E188 IonicContact NH1-OE1 2.68Å; R184-E188 PolarHBondContact NH1-OE1 3.49Å; R184-E188 IonicContact NH1-OE2 2.7Å; R184-E188 PolarHBondContact NH1-OE2 3.04Å; R184-E188 PolarHBondContact O-N 2.94Å; Q185-E188 PolarHBondContact O-N 3.38Å; Q185-E188 VanDerWaalsContact O-N 3.13Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.38Å; E188-L191 PolarHBondContact O-N 3.3Å; E188-A192 WeakPolarHBondContact O-CB 3.24Å; E188-A192 PolarHBondContact O-N 3.11Å
189	D	94.8	Very high	90.3	Very high	86 Å²	86	89.4 Å²	89.4	46%	0.46	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-41.4	174	-65.3	-13.7	0	0	0	110.9	Q185 A192 V193	Q185-D189 PolarHBondContact NE2-OD1 3.48Å; Q185-D189 WeakPolarHBondContact O-CB 3.43Å; Q185-D189 PolarHBondContact O-N 2.87Å; D189-A192 PolarHBondContact O-N 3.01Å; D189-V193 WeakPolarHBondContact O-CG2 3.41Å; D189-V193 PolarHBondContact O-N 3.36Å
190	A	94	Very high	88.8	Confident	52 Å²	52	89.8 Å²	89.8	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-64.6	-43.4	175.5	0	0	0	0	0	112.4	A186 A187 E188 A192 V193 I194	A186-A190 WeakPolarHBondContact O-CB 3.47Å; A186-A190 PolarHBondContact O-N 3Å; A187-A190 PolarHBondContact O-N 3.42Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.38Å; A190-A192 VanDerWaalsContact C-N 3.35Å; A190-V193 PolarHBondContact O-N 2.86Å; A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.45Å; A190-I194 VanDerWaalsContact O-N 3.1Å
191	L	92.8	Very high	87.6	Confident	115 Å²	115	89 Å²	89	60%	0.602	49%	0.492	S	S	*	.	H	α-helix	trans	-64.2	-38.7	174.2	-71.2	170.4	0	0	0	111.9	A187 E188 V193 I194 N195	A187-L191 WeakPolarHBondContact O-CG 3.38Å; A187-L191 PolarHBondContact O-N 2.86Å; E188-L191 PolarHBondContact O-N 3.3Å; L191-V193 VanDerWaalsContact C-N 3.34Å; L191-V193 PolarHBondContact O-N 2.98Å; L191-I194 PolarHBondContact O-N 3.4Å; L191-N195 WeakPolarHBondContact O-CB 3.38Å; L191-N195 PolarHBondContact O-N 3.44Å
192	A	92.6	Very high	86.8	Confident	45 Å²	45	88 Å²	88	37%	0.372	49%	0.487	S	S	.	.	H	α-helix	trans	-65.5	-35.3	176.4	0	0	0	0	0	112.4	E188 D189 A190 Q196	E188-A192 WeakPolarHBondContact O-CB 3.24Å; E188-A192 PolarHBondContact O-N 3.11Å; D189-A192 PolarHBondContact O-N 3.01Å; A190-A192 VanDerWaalsContact C-N 3.35Å; A192-Q196 WeakPolarHBondContact O-CB 3.45Å; A192-Q196 VanDerWaalsContact O-CG 3.3Å; A192-Q196 WeakPolarHBondContact O-CG 3.44Å; A192-Q196 PolarHBondContact O-N 3.37Å; A192-Q196 VanDerWaalsContact O-N 3.13Å; A192-Q196 PolarHBondContact O-NE2 3.23Å
193	V	89.5	Confident	86.5	Confident	93 Å²	93	87 Å²	87	56%	0.564	48%	0.476	S	S	*	.	H	α-helix	trans	-66.2	-44.3	172.3	169.3	0	0	0	0	111.2	D189 A190 L191 Q196 Q197	D189-V193 WeakPolarHBondContact O-CG2 3.41Å; D189-V193 PolarHBondContact O-N 3.36Å; A190-V193 PolarHBondContact O-N 2.86Å; L191-V193 VanDerWaalsContact C-N 3.34Å; L191-V193 PolarHBondContact O-N 2.98Å; V193-Q196 PolarHBondContact O-N 2.88Å; V193-Q197 PolarHBondContact O-N 2.85Å
194	I	86.1	Confident	86.2	Confident	91 Å²	91	80.1 Å²	80.1	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-61.1	-49.9	177.7	-67	164.1	0	0	0	110.7	A190 L191 Q196 Q197 E198	A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.45Å; A190-I194 VanDerWaalsContact O-N 3.1Å; L191-I194 PolarHBondContact O-N 3.4Å; I194-Q196 VanDerWaalsContact C-N 3.31Å; I194-Q196 PolarHBondContact O-N 2.95Å; I194-Q197 WeakPolarHBondContact O-CA 3.49Å; I194-Q197 WeakPolarHBondContact O-CB 3.37Å; I194-Q197 PolarHBondContact O-N 3.48Å; I194-E198 PolarHBondContact O-N 2.69Å
195	N	84	Confident	85.9	Confident	89 Å²	89	81.3 Å²	81.3	48%	0.476	45%	0.451	S	S	.	.	H	α-helix	trans	-61.4	-38.1	180	-165.8	116.2	0	0	0	111.9	L191 Q197 E198 D199	L191-N195 WeakPolarHBondContact O-CB 3.38Å; L191-N195 PolarHBondContact O-N 3.44Å; N195-Q197 VanDerWaalsContact C-N 3.32Å; N195-Q197 PolarHBondContact O-N 2.71Å; N195-E198 PolarHBondContact O-N 3.12Å; N195-D199 PolarHBondContact ND2-OD2 3.41Å; N195-D199 WeakPolarHBondContact O-CB 3.49Å; N195-D199 PolarHBondContact O-N 3.49Å
196	Q	80.6	Confident	85.7	Confident	127 Å²	127	80.3 Å²	80.3	59%	0.593	45%	0.448	S	S	*	.	H	α-helix	trans	-66	-32.9	174.2	-78	170.4	94.6	0	0	112.6	A192 V193 I194 S200	A192-Q196 WeakPolarHBondContact O-CB 3.45Å; A192-Q196 VanDerWaalsContact O-CG 3.3Å; A192-Q196 WeakPolarHBondContact O-CG 3.44Å; A192-Q196 PolarHBondContact O-N 3.37Å; A192-Q196 VanDerWaalsContact O-N 3.13Å; A192-Q196 PolarHBondContact O-NE2 3.23Å; V193-Q196 PolarHBondContact O-N 2.88Å; I194-Q196 VanDerWaalsContact C-N 3.31Å; I194-Q196 PolarHBondContact O-N 2.95Å; Q196-S200 VanDerWaalsContact O-CB 3.28Å; Q196-S200 WeakPolarHBondContact O-CB 3.49Å; Q196-S200 PolarHBondContact O-N 2.89Å; Q196-S200 VanDerWaalsContact O-N 3.11Å; Q196-S200 PolarHBondContact O-OG 2.97Å
197	Q	71.3	Confident	85.4	Confident	134 Å²	134	79.9 Å²	79.9	63%	0.626	44%	0.441	S	S	*	.	H	α-helix	trans	-70.3	-37.6	174.7	-174	173.3	-13.1	0	0	111.7	V193 I194 N195 S200 S201	V193-Q197 PolarHBondContact O-N 2.85Å; I194-Q197 WeakPolarHBondContact O-CA 3.49Å; I194-Q197 WeakPolarHBondContact O-CB 3.37Å; I194-Q197 PolarHBondContact O-N 3.48Å; N195-Q197 VanDerWaalsContact C-N 3.32Å; N195-Q197 PolarHBondContact O-N 2.71Å; Q197-S200 PolarHBondContact O-OG 2.87Å; Q197-S201 VanDerWaalsContact O-CB 3.22Å; Q197-S201 WeakPolarHBondContact O-CB 3.49Å; Q197-S201 PolarHBondContact O-N 3.28Å; Q197-S201 PolarHBondContact O-OG 3.47Å
198	E	70.5	Confident	85	Confident	115 Å²	115	80.1 Å²	80.1	54%	0.537	45%	0.449	S	S	.	.	H	α-helix	trans	-67.6	-53.4	173.9	-66.3	-172.3	129.4	0	0	111.5	I194 N195 S200 S201 E202	I194-E198 PolarHBondContact O-N 2.69Å; N195-E198 PolarHBondContact O-N 3.12Å; E198-S200 VanDerWaalsContact C-N 3.27Å; E198-S200 PolarHBondContact O-N 3.29Å; E198-S201 PolarHBondContact O-N 3.1Å; E198-S201 PolarHBondContact O-OG 3.46Å; E198-E202 PolarHBondContact O-N 3Å
199	D	68.4	Low	84.7	Confident	107 Å²	107	84.2 Å²	84.2	57%	0.572	46%	0.461	S	S	*	.	H	α-helix	trans	-56.9	-36.9	178.8	-83.7	-38.2	0	0	0	113.2	N195	N195-D199 PolarHBondContact ND2-OD2 3.41Å; N195-D199 WeakPolarHBondContact O-CB 3.49Å; N195-D199 PolarHBondContact O-N 3.49Å
200	S	67	Low	84.6	Confident	73 Å²	73	86.9 Å²	86.9	51%	0.51	47%	0.468	S	S	.	.	H	α-helix	trans	-77.9	-40.3	178.6	57.6	0	0	0	0	113	Q196 Q197 E198 E202 S203	Q196-S200 VanDerWaalsContact O-CB 3.28Å; Q196-S200 WeakPolarHBondContact O-CB 3.49Å; Q196-S200 PolarHBondContact O-N 2.89Å; Q196-S200 VanDerWaalsContact O-N 3.11Å; Q196-S200 PolarHBondContact O-OG 2.97Å; Q197-S200 PolarHBondContact O-OG 2.87Å; E198-S200 VanDerWaalsContact C-N 3.27Å; E198-S200 PolarHBondContact O-N 3.29Å; S200-E202 VanDerWaalsContact C-N 3.31Å; S200-E202 PolarHBondContact O-N 3.28Å; S200-S203 WeakPolarHBondContact O-CB 3.46Å; S200-S203 PolarHBondContact O-N 3.13Å; S200-S203 PolarHBondContact O-OG 3Å
201	S	72.2	Confident	84.4	Confident	67 Å²	67	85 Å²	85	47%	0.469	45%	0.452	S	S	.	.	H	α-helix	trans	-73.6	-20.4	178.8	63.9	0	0	0	0	113.7	Q197 E198	Q197-S201 VanDerWaalsContact O-CB 3.22Å; Q197-S201 WeakPolarHBondContact O-CB 3.49Å; Q197-S201 PolarHBondContact O-N 3.28Å; Q197-S201 PolarHBondContact O-OG 3.47Å; E198-S201 PolarHBondContact O-N 3.1Å; E198-S201 PolarHBondContact O-OG 3.46Å
202	E	81.5	Confident	84.2	Confident	75 Å²	75	84 Å²	84	35%	0.35	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	14.3	169.9	-68.2	-168.7	114.5	0	0	114.1	E198 S200 K210 A211	E198-E202 PolarHBondContact O-N 3Å; S200-E202 VanDerWaalsContact C-N 3.31Å; S200-E202 PolarHBondContact O-N 3.28Å; E202-K210 CarbonylContact O-C 3.55Å; E202-K210 WeakPolarHBondContact O-CA 3.23Å; E202-K210 WeakPolarHBondContact OE1-CE 3.39Å; E202-K210 IonicContact OE1-NZ 3.09Å; E202-K210 PolarHBondContact OE1-NZ 3.07Å; E202-K210 WeakPolarHBondContact OE2-CE 3.38Å; E202-K210 IonicContact OE2-NZ 2.72Å; E202-K210 PolarHBondContact OE2-NZ 2.91Å; E202-A211 WeakPolarHBondContact O-CB 3.48Å; E202-A211 PolarHBondContact O-N 3.35Å
203	S	90.6	Very high	83.9	Confident	41 Å²	41	85.9 Å²	85.9	29%	0.287	46%	0.456	S	S	.	.	B	Isolated β-bridge	trans	-86.7	140.4	-179.5	69.2	0	0	0	0	114.2	S200 W205	S200-S203 WeakPolarHBondContact O-CB 3.46Å; S200-S203 PolarHBondContact O-N 3.13Å; S200-S203 PolarHBondContact O-OG 3Å; S203-W205 PolarHBondContact O-N 3.25Å
204	C	91.9	Very high	84	Confident	2 Å²	2	84 Å²	84	1%	0.014	45%	0.445	C	S	.	.			trans	-76.6	116.8	178.4	175.4	0	0	0	0	111.6	N206 C207 G208 R209 A211 R222 C224	C204-N206 PolarHBondContact O-N 2.88Å; C204-C207 PolarHBondContact O-N 3.34Å; C204-G208 PolarHBondContact O-N 3.05Å; C204-R209 WeakPolarHBondContact CB-O 3.3Å; C204-R209 PolarHBondContact N-O 3.38Å; C204-A211 HydrophobicContact CB-CB 4.48Å; C204-R222 WeakPolarHBondContact CA-O 3.2Å; C204-C224 HydrophobicContact CB-CB 3.98Å; C204-C224 PolarHBondContact SG-N 2.9Å; C204-C224 VanDerWaalsContact SG-SG 3.62Å
205	W	91.6	Very high	84.3	Confident	123 Å²	123	79.8 Å²	79.8	47%	0.466	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-31	-173.1	-74.5	31.6	0	0	0	114.1	S203 A221 R222 Y223 I239	S203-W205 PolarHBondContact O-N 3.25Å; W205-A221 HydrophobicContact CD2-CB 3.71Å; W205-A221 HydrophobicContact CE3-CB 3.77Å; W205-A221 HydrophobicContact CG-CB 4.36Å; W205-A221 HydrophobicContact CH2-CB 4.06Å; W205-A221 HydrophobicContact CZ2-CB 3.98Å; W205-A221 HydrophobicContact CZ3-CB 3.96Å; W205-R222 PolarHBondContact N-O 3.4Å; W205-Y223 HydrophobicContact CB-CD1 4.48Å; W205-Y223 HydrophobicContact CB-CE1 3.94Å; W205-I239 HydrophobicContact CH2-CD1 4.49Å; W205-I239 HydrophobicContact CZ3-CD1 4.04Å
206	N	91.3	Very high	84.5	Confident	54 Å²	54	80.7 Å²	80.7	29%	0.289	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-22	179.3	-178.4	59.5	0	0	0	114.6	C204 C228 D232	C204-N206 PolarHBondContact O-N 2.88Å; N206-C228 HydrophobicContact CB-CB 3.9Å; N206-C228 PolarHBondContact ND2-SG 2.91Å; N206-C228 VanDerWaalsContact ND2-SG 3.4Å; N206-D232 HydrophobicContact CB-CB 4.26Å
207	C	91.1	Very high	84.9	Confident	51 Å²	51	76.6 Å²	76.6	35%	0.345	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.6	10.1	-170.4	74.6	0	0	0	0	117.4	C204 R209 C224	C204-C207 PolarHBondContact O-N 3.34Å; C207-R209 PolarHBondContact O-N 3.47Å; C207-C224 VanDerWaalsContact SG-SG 3.61Å
208	G	87.4	Confident	85.8	Confident	58 Å²	58	70.4 Å²	70.4	60%	0.598	40%	0.4	S	S	*	.	S	Bend	trans	70.7	-20.8	173.7	0	0	0	0	0	116.9	C204	C204-G208 PolarHBondContact O-N 3.05Å
209	R	90.4	Very high	86.6	Confident	171 Å²	171	69.9 Å²	69.9	65%	0.645	40%	0.401	S	S	*	.	S	Bend	trans	-65.9	155.1	177	-63.9	-174.8	-65.5	176.1	1.3	111.8	C204 C207 A211	C204-R209 WeakPolarHBondContact CB-O 3.3Å; C204-R209 PolarHBondContact N-O 3.38Å; C207-R209 PolarHBondContact O-N 3.47Å; R209-A211 PolarHBondContact O-N 3.43Å
210	K	90.9	Very high	87.6	Confident	141 Å²	141	67.2 Å²	67.2	61%	0.613	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-50.7	127.6	178	179.7	156.6	177.8	147.7	0	111.8	E202 C224	E202-K210 CarbonylContact O-C 3.55Å; E202-K210 WeakPolarHBondContact O-CA 3.23Å; E202-K210 WeakPolarHBondContact OE1-CE 3.39Å; E202-K210 IonicContact OE1-NZ 3.09Å; E202-K210 PolarHBondContact OE1-NZ 3.07Å; E202-K210 WeakPolarHBondContact OE2-CE 3.38Å; E202-K210 IonicContact OE2-NZ 2.72Å; E202-K210 PolarHBondContact OE2-NZ 2.91Å; K210-C224 WeakPolarHBondContact O-CB 3.34Å
211	A	91.3	Very high	88.7	Confident	12 Å²	12	63.7 Å²	63.7	10%	0.099	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-81.1	151.8	176.4	0	0	0	0	0	111.1	E202 C204 R209 R222 Y223	E202-A211 WeakPolarHBondContact O-CB 3.48Å; E202-A211 PolarHBondContact O-N 3.35Å; C204-A211 HydrophobicContact CB-CB 4.48Å; R209-A211 PolarHBondContact O-N 3.43Å; A211-R222 HydrophobicContact CB-CB 3.75Å; A211-Y223 WeakPolarHBondContact CA-O 3.39Å; A211-Y223 WeakPolarHBondContact CB-O 3.41Å
212	S	87.6	Confident	89.7	Confident	95 Å²	95	64.7 Å²	64.7	66%	0.664	36%	0.358	S	S	*	.			trans	-128.6	-15.2	177.2	56.5	0	0	0	0	112.1	Y223	S212-Y223 PolarHBondContact N-O 3.07Å
213	E	87.5	Confident	90.3	Very high	84 Å²	84	61.2 Å²	61.2	39%	0.393	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	147.1	-175.3	-70.2	172.4	-162.5	0	0	109.8	Y223 G225 S226	E213-Y223 PolarHBondContact N-O 2.98Å; E213-Y223 PolarHBondContact O-N 2.76Å; E213-G225 VanDerWaalsContact OE2-C 3.29Å; E213-G225 VanDerWaalsContact OE2-CA 3.28Å; E213-G225 WeakPolarHBondContact OE2-CA 3.47Å; E213-S226 PolarHBondContact OE2-N 3.17Å
214	T	91.6	Very high	90.4	Very high	55 Å²	55	61 Å²	61	34%	0.337	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.5	178.8	-62.9	0	0	0	0	109.2	S216 N219 R222	T214-S216 PolarHBondContact O-N 3.02Å; T214-S216 VanDerWaalsContact O-N 3.07Å; T214-N219 VanDerWaalsContact CG2-C 3.46Å; T214-N219 HydrophobicContact CG2-CB 4.31Å; T214-N219 VanDerWaalsContact CG2-O 3.3Å; T214-N219 WeakPolarHBondContact CG2-O 3.32Å; T214-R222 WeakPolarHBondContact OG1-CD 3.44Å; T214-R222 PolarHBondContact OG1-NE 3.33Å
215	C	91.5	Very high	90.4	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.007	35%	0.346	C	S	.	.			trans	-64.7	109.8	178.2	-168.8	0	0	0	0	111.8	G217 C218 N219 A221 Y223 H236	C215-G217 PolarHBondContact O-N 2.82Å; C215-C218 PolarHBondContact O-N 2.93Å; C215-C218 VanDerWaalsContact O-N 3.14Å; C215-N219 WeakPolarHBondContact O-CA 3.07Å; C215-N219 PolarHBondContact O-N 2.75Å; C215-A221 HydrophobicContact CB-CB 4.24Å; C215-A221 PolarHBondContact N-O 2.89Å; C215-Y223 HydrophobicContact CB-CE2 4.12Å; C215-H236 PolarHBondContact SG-NE2 3.3Å; C215-H236 VanDerWaalsContact SG-NE2 3.41Å
216	S	88.9	Confident	90.4	Very high	108 Å²	108	58 Å²	58	76%	0.755	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.5	-176.7	51.3	0	0	0	0	115.4	T214	T214-S216 PolarHBondContact O-N 3.02Å; T214-S216 VanDerWaalsContact O-N 3.07Å
217	G	88.3	Confident	90.5	Very high	42 Å²	42	63 Å²	63	43%	0.433	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-21.6	178.5	0	0	0	0	0	115.2	C215	C215-G217 PolarHBondContact O-N 2.82Å
218	C	89.9	Confident	90.7	Very high	4 Å²	4	61 Å²	61	3%	0.027	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	-6.2	-175.1	68	0	0	0	0	115.1	C215 T220 H236	C215-C218 PolarHBondContact O-N 2.93Å; C215-C218 VanDerWaalsContact O-N 3.14Å; C218-T220 PolarHBondContact O-N 2.88Å; C218-T220 PolarHBondContact O-OG1 3.06Å; C218-H236 VanDerWaalsContact SG-CE1 3.55Å
219	N	88.1	Confident	90.9	Very high	104 Å²	104	59.9 Å²	59.9	56%	0.556	33%	0.325	S	S	*	.	S	Bend	trans	49.6	9.7	-172.7	-70.7	-15.8	0	0	0	116.7	T214 C215 R222	T214-N219 VanDerWaalsContact CG2-C 3.46Å; T214-N219 HydrophobicContact CG2-CB 4.31Å; T214-N219 VanDerWaalsContact CG2-O 3.3Å; T214-N219 WeakPolarHBondContact CG2-O 3.32Å; C215-N219 WeakPolarHBondContact O-CA 3.07Å; C215-N219 PolarHBondContact O-N 2.75Å; N219-R222 PolarHBondContact O-NH2 3.33Å
220	T	88.9	Confident	91	Very high	50 Å²	50	58.1 Å²	58.1	31%	0.307	32%	0.324	S	S	.	.			trans	-97.8	-62.9	-172.2	-51.3	0	0	0	0	110.7	C218 R222 T243	C218-T220 PolarHBondContact O-N 2.88Å; C218-T220 PolarHBondContact O-OG1 3.06Å; T220-R222 PolarHBondContact O-NE 3.43Å; T220-R222 VanDerWaalsContact O-NE 3.1Å; T220-T243 HydrophobicContact CG2-CG2 4.33Å; T220-T243 VanDerWaalsContact OG1-CB 3.25Å; T220-T243 WeakPolarHBondContact OG1-CB 3.42Å; T220-T243 WeakPolarHBondContact OG1-CG2 3.45Å; T220-T243 PolarHBondContact OG1-OG1 3.31Å
221	A	91.1	Very high	91.2	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.323	C	S	.	.			trans	-69.8	145.4	-176.9	0	0	0	0	0	113	W205 C215 Y223 H236	W205-A221 HydrophobicContact CD2-CB 3.71Å; W205-A221 HydrophobicContact CE3-CB 3.77Å; W205-A221 HydrophobicContact CG-CB 4.36Å; W205-A221 HydrophobicContact CH2-CB 4.06Å; W205-A221 HydrophobicContact CZ2-CB 3.98Å; W205-A221 HydrophobicContact CZ3-CB 3.96Å; C215-A221 HydrophobicContact CB-CB 4.24Å; C215-A221 PolarHBondContact N-O 2.89Å; A221-Y223 HydrophobicContact CB-CE2 3.85Å; A221-H236 WeakPolarHBondContact CB-CE1 3.35Å
222	R	92.3	Very high	91.1	Very high	88 Å²	88	58 Å²	58	33%	0.332	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.3	-170.3	-55.4	-62.7	163	118.8	-17.7	111	C204 W205 A211 T214 N219 T220	C204-R222 WeakPolarHBondContact CA-O 3.2Å; W205-R222 PolarHBondContact N-O 3.4Å; A211-R222 HydrophobicContact CB-CB 3.75Å; T214-R222 WeakPolarHBondContact OG1-CD 3.44Å; T214-R222 PolarHBondContact OG1-NE 3.33Å; N219-R222 PolarHBondContact O-NH2 3.33Å; T220-R222 PolarHBondContact O-NE 3.43Å; T220-R222 VanDerWaalsContact O-NE 3.1Å
223	Y	93.4	Very high	91.3	Very high	1 Å²	1	59.2 Å²	59.2	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	147.8	-175	-56.3	-76.2	0	0	0	112.3	W205 A211 S212 E213 C215 A221 G225 C228 Q229 D232	W205-Y223 HydrophobicContact CB-CD1 4.48Å; W205-Y223 HydrophobicContact CB-CE1 3.94Å; A211-Y223 WeakPolarHBondContact CA-O 3.39Å; A211-Y223 WeakPolarHBondContact CB-O 3.41Å; S212-Y223 PolarHBondContact N-O 3.07Å; E213-Y223 PolarHBondContact N-O 2.98Å; E213-Y223 PolarHBondContact O-N 2.76Å; C215-Y223 HydrophobicContact CB-CE2 4.12Å; A221-Y223 HydrophobicContact CB-CE2 3.85Å; Y223-G225 PolarHBondContact O-N 3.13Å; Y223-G225 VanDerWaalsContact O-N 3.11Å; Y223-C228 HydrophobicContact CD1-CB 4.05Å; Y223-Q229 HydrophobicContact CD1-CB 4.31Å; Y223-Q229 HydrophobicContact CD2-CB 3.63Å; Y223-Q229 HydrophobicContact CD2-CG 3.88Å; Y223-Q229 HydrophobicContact CE2-CB 3.91Å; Y223-Q229 HydrophobicContact CE2-CG 3.76Å; Y223-Q229 HydrophobicContact CG-CB 3.85Å; Y223-D232 HydrophobicContact CE1-CB 4.07Å
224	C	93.4	Very high	91.4	Very high	36 Å²	36	63 Å²	63	24%	0.243	33%	0.329	C	S	.	.	S	Bend	trans	-83.7	38.3	174.4	70.1	0	0	0	0	112.4	C204 C207 K210 C228	C204-C224 HydrophobicContact CB-CB 3.98Å; C204-C224 PolarHBondContact SG-N 2.9Å; C204-C224 VanDerWaalsContact SG-SG 3.62Å; C207-C224 VanDerWaalsContact SG-SG 3.61Å; K210-C224 WeakPolarHBondContact O-CB 3.34Å; C224-C228 VanDerWaalsContact SG-SG 3.64Å
225	G	91.6	Very high	91.4	Very high	15 Å²	15	67.1 Å²	67.1	16%	0.155	34%	0.342	C	S	.	.	S	Bend	trans	117.3	144.4	-171.8	0	0	0	0	0	114	E213 Y223 F227 C228	E213-G225 VanDerWaalsContact OE2-C 3.29Å; E213-G225 VanDerWaalsContact OE2-CA 3.28Å; E213-G225 WeakPolarHBondContact OE2-CA 3.47Å; Y223-G225 PolarHBondContact O-N 3.13Å; Y223-G225 VanDerWaalsContact O-N 3.11Å; G225-F227 PolarHBondContact O-N 3.14Å; G225-C228 PolarHBondContact O-N 3.4Å
226	S	92.3	Very high	91.3	Very high	47 Å²	47	67.2 Å²	67.2	33%	0.329	34%	0.343	S	S	.	.	H	α-helix	trans	-50.8	-25.8	-175.3	-170.5	0	0	0	0	115.9	E213 C228 Q229 H230	E213-S226 PolarHBondContact OE2-N 3.17Å; S226-C228 VanDerWaalsContact C-N 3.29Å; S226-C228 PolarHBondContact O-N 3.1Å; S226-Q229 WeakPolarHBondContact O-CB 3.41Å; S226-Q229 PolarHBondContact O-N 2.82Å; S226-H230 PolarHBondContact O-N 3.2Å; S226-H230 PolarHBondContact O-ND1 3.29Å; S226-H230 PolarHBondContact OG-CE1 3.45Å; S226-H230 PolarHBondContact OG-ND1 3.26Å
227	F	93.4	Very high	91.4	Very high	161 Å²	161	65.8 Å²	65.8	71%	0.706	32%	0.324	S	S	*	.	H	α-helix	trans	-57.8	-41	172	176.9	-97.7	0	0	0	112.4	G225 K231	G225-F227 PolarHBondContact O-N 3.14Å; F227-K231 HydrophobicContact CE1-CG 4.43Å; F227-K231 HydrophobicContact CZ-CG 4.43Å; F227-K231 WeakPolarHBondContact O-CB 3.5Å; F227-K231 PolarHBondContact O-N 2.98Å; F227-K231 VanDerWaalsContact O-N 3.12Å
228	C	94.3	Very high	91.5	Very high	8 Å²	8	70 Å²	70	5%	0.054	33%	0.332	C	S	.	.	H	α-helix	trans	-71.9	-33.5	177.3	-76	0	0	0	0	112.5	N206 Y223 C224 G225 S226 K231 D232	N206-C228 HydrophobicContact CB-CB 3.9Å; N206-C228 PolarHBondContact ND2-SG 2.91Å; N206-C228 VanDerWaalsContact ND2-SG 3.4Å; Y223-C228 HydrophobicContact CD1-CB 4.05Å; C224-C228 VanDerWaalsContact SG-SG 3.64Å; G225-C228 PolarHBondContact O-N 3.4Å; S226-C228 VanDerWaalsContact C-N 3.29Å; S226-C228 PolarHBondContact O-N 3.1Å; C228-K231 PolarHBondContact O-N 3.28Å; C228-D232 PolarHBondContact O-N 3.16Å; C228-D232 VanDerWaalsContact O-N 3.15Å
229	Q	93.1	Very high	91.4	Very high	35 Å²	35	73.6 Å²	73.6	16%	0.164	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-49.3	174.1	-177.9	-173.6	9.9	0	0	111.2	Y223 S226 K231 D232 W233	Y223-Q229 HydrophobicContact CD1-CB 4.31Å; Y223-Q229 HydrophobicContact CD2-CB 3.63Å; Y223-Q229 HydrophobicContact CD2-CG 3.88Å; Y223-Q229 HydrophobicContact CE2-CB 3.91Å; Y223-Q229 HydrophobicContact CE2-CG 3.76Å; Y223-Q229 HydrophobicContact CG-CB 3.85Å; S226-Q229 WeakPolarHBondContact O-CB 3.41Å; S226-Q229 PolarHBondContact O-N 2.82Å; Q229-K231 VanDerWaalsContact C-N 3.28Å; Q229-K231 PolarHBondContact O-N 3.44Å; Q229-D232 PolarHBondContact O-N 2.87Å; Q229-W233 PolarHBondContact O-N 3.39Å
230	H	92.4	Very high	91.3	Very high	134 Å²	134	70 Å²	70	62%	0.62	33%	0.333	S	S	*	.	H	α-helix	trans	-63.7	-34.4	176.6	-70	97.4	0	0	0	112.2	S226 D232	S226-H230 PolarHBondContact O-N 3.2Å; S226-H230 PolarHBondContact O-ND1 3.29Å; S226-H230 PolarHBondContact OG-CE1 3.45Å; S226-H230 PolarHBondContact OG-ND1 3.26Å; H230-D232 PolarHBondContact O-N 3.45Å
231	K	93.3	Very high	90.7	Very high	138 Å²	138	69 Å²	69	60%	0.6	33%	0.333	S	S	*	.	H	α-helix	trans	-69.3	-28.5	179	-112.8	-67.3	174.8	-168.4	0	114.4	F227 C228 Q229	F227-K231 HydrophobicContact CE1-CG 4.43Å; F227-K231 HydrophobicContact CZ-CG 4.43Å; F227-K231 WeakPolarHBondContact O-CB 3.5Å; F227-K231 PolarHBondContact O-N 2.98Å; F227-K231 VanDerWaalsContact O-N 3.12Å; C228-K231 PolarHBondContact O-N 3.28Å; Q229-K231 VanDerWaalsContact C-N 3.28Å; Q229-K231 PolarHBondContact O-N 3.44Å
232	D	91.1	Very high	89.7	Confident	13 Å²	13	75.7 Å²	75.7	7%	0.07	36%	0.364	C	S	.	.	H	α-helix	trans	-101.9	-5.6	178.2	-160.1	53.7	0	0	0	113.6	N206 Y223 C228 Q229 H230 E234 K235 H236	N206-D232 HydrophobicContact CB-CB 4.26Å; Y223-D232 HydrophobicContact CE1-CB 4.07Å; C228-D232 PolarHBondContact O-N 3.16Å; C228-D232 VanDerWaalsContact O-N 3.15Å; Q229-D232 PolarHBondContact O-N 2.87Å; H230-D232 PolarHBondContact O-N 3.45Å; D232-E234 VanDerWaalsContact C-N 3.26Å; D232-E234 PolarHBondContact O-N 2.9Å; D232-E234 VanDerWaalsContact O-N 3.15Å; D232-K235 PolarHBondContact O-N 3.08Å; D232-K235 IonicContact OD1-NZ 2.74Å; D232-K235 PolarHBondContact OD1-NZ 2.84Å; D232-H236 PolarHBondContact O-N 3Å
233	W	91.4	Very high	88.2	Confident	120 Å²	120	74 Å²	74	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-50.8	-41.6	-177.2	-179.3	-111.1	0	0	0	113.6	Q229 K235 H236 H237 C240	Q229-W233 PolarHBondContact O-N 3.39Å; W233-K235 PolarHBondContact O-N 2.78Å; W233-K235 VanDerWaalsContact O-N 3.14Å; W233-H236 PolarHBondContact O-N 3.21Å; W233-H237 HydrophobicContact CD2-CB 3.84Å; W233-H237 HydrophobicContact CE3-CB 4.05Å; W233-H237 HydrophobicContact CH2-CB 3.77Å; W233-H237 HydrophobicContact CZ2-CB 3.54Å; W233-H237 HydrophobicContact CZ3-CB 4.02Å; W233-H237 VanDerWaalsContact O-CB 3.32Å; W233-H237 WeakPolarHBondContact O-CB 3.47Å; W233-H237 PolarHBondContact O-N 2.94Å; W233-H237 PolarHBondContact O-ND1 3.2Å; W233-C240 HydrophobicContact CZ3-CB 4.28Å
234	E	89.6	Confident	86.5	Confident	163 Å²	163	78.1 Å²	78.1	76%	0.762	39%	0.385	S	S	*	.	H	α-helix	trans	-55.8	-30.2	176.7	-67.5	178.4	174.4	0	0	113.2	D232 H237	D232-E234 VanDerWaalsContact C-N 3.26Å; D232-E234 PolarHBondContact O-N 2.9Å; D232-E234 VanDerWaalsContact O-N 3.15Å; E234-H237 PolarHBondContact O-CE1 3.09Å; E234-H237 PolarHBondContact O-ND1 3.16Å; E234-H237 VanDerWaalsContact O-ND1 3.08Å
235	K	90.3	Very high	84.8	Confident	141 Å²	141	84.3 Å²	84.3	61%	0.613	41%	0.411	S	S	*	.	H	α-helix	trans	-92.3	-44.7	174	-49.6	-171	-149.2	114.4	0	111.8	D232 W233	D232-K235 PolarHBondContact O-N 3.08Å; D232-K235 IonicContact OD1-NZ 2.74Å; D232-K235 PolarHBondContact OD1-NZ 2.84Å; W233-K235 PolarHBondContact O-N 2.78Å; W233-K235 VanDerWaalsContact O-N 3.14Å
236	H	91	Very high	82.9	Confident	4 Å²	4	87.3 Å²	87.3	2%	0.019	43%	0.434	C	S	.	.	H	α-helix	trans	-68.8	-34.7	-172.5	178.5	54.3	0	0	0	113.6	C215 C218 A221 D232 W233 H238 I239 C240	C215-H236 PolarHBondContact SG-NE2 3.3Å; C215-H236 VanDerWaalsContact SG-NE2 3.41Å; C218-H236 VanDerWaalsContact SG-CE1 3.55Å; A221-H236 WeakPolarHBondContact CB-CE1 3.35Å; D232-H236 PolarHBondContact O-N 3Å; W233-H236 PolarHBondContact O-N 3.21Å; H236-H238 VanDerWaalsContact C-N 3.25Å; H236-H238 PolarHBondContact O-N 3.37Å; H236-H238 VanDerWaalsContact O-N 3.15Å; H236-I239 WeakPolarHBondContact O-CG1 3.2Å; H236-I239 PolarHBondContact O-N 2.82Å; H236-C240 WeakPolarHBondContact O-CB 3.46Å; H236-C240 PolarHBondContact O-N 3.12Å
237	H	89.6	Confident	80.9	Confident	77 Å²	77	93 Å²	93	36%	0.356	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.6	-170.7	77.6	-71.8	0	0	0	114	W233 E234 I239 C240	W233-H237 HydrophobicContact CD2-CB 3.84Å; W233-H237 HydrophobicContact CE3-CB 4.05Å; W233-H237 HydrophobicContact CH2-CB 3.77Å; W233-H237 HydrophobicContact CZ2-CB 3.54Å; W233-H237 HydrophobicContact CZ3-CB 4.02Å; W233-H237 VanDerWaalsContact O-CB 3.32Å; W233-H237 WeakPolarHBondContact O-CB 3.47Å; W233-H237 PolarHBondContact O-N 2.94Å; W233-H237 PolarHBondContact O-ND1 3.2Å; E234-H237 PolarHBondContact O-CE1 3.09Å; E234-H237 PolarHBondContact O-ND1 3.16Å; E234-H237 VanDerWaalsContact O-ND1 3.08Å; H237-I239 PolarHBondContact O-N 3.09Å; H237-C240 PolarHBondContact O-N 3.06Å
238	H	90.1	Very high	78.9	Confident	130 Å²	130	92.5 Å²	92.5	60%	0.602	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.1	176	-63.2	-50.9	0	0	0	114	H236 Q242	H236-H238 VanDerWaalsContact C-N 3.25Å; H236-H238 PolarHBondContact O-N 3.37Å; H236-H238 VanDerWaalsContact O-N 3.15Å; H238-Q242 PolarHBondContact O-NE2 3.06Å; H238-Q242 VanDerWaalsContact O-NE2 3.14Å
239	I	87.9	Confident	76.5	Confident	80 Å²	80	101.5 Å²	101.5	41%	0.41	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-7.7	179.1	57	173.1	0	0	0	113	W205 H236 H237 G241 Q242	W205-I239 HydrophobicContact CH2-CD1 4.49Å; W205-I239 HydrophobicContact CZ3-CD1 4.04Å; H236-I239 WeakPolarHBondContact O-CG1 3.2Å; H236-I239 PolarHBondContact O-N 2.82Å; H237-I239 PolarHBondContact O-N 3.09Å; I239-G241 VanDerWaalsContact C-N 3.28Å; I239-G241 PolarHBondContact O-N 2.83Å; I239-Q242 PolarHBondContact O-N 2.65Å
240	C	87.4	Confident	74.1	Confident	29 Å²	29	102.9 Å²	102.9	20%	0.196	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	76.2	180	-176.3	0	0	0	0	112.3	W233 H236 H237	W233-C240 HydrophobicContact CZ3-CB 4.28Å; H236-C240 WeakPolarHBondContact O-CB 3.46Å; H236-C240 PolarHBondContact O-N 3.12Å; H237-C240 PolarHBondContact O-N 3.06Å
241	G	75.1	Confident	71.7	Confident	30 Å²	30	103.9 Å²	103.9	31%	0.309	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	157.9	-23	173.9	0	0	0	0	0	113.9	I239 T243 L244	I239-G241 VanDerWaalsContact C-N 3.28Å; I239-G241 PolarHBondContact O-N 2.83Å; G241-T243 VanDerWaalsContact C-N 3.32Å; G241-T243 PolarHBondContact O-N 3.2Å; G241-L244 PolarHBondContact O-N 3.4Å
242	Q	71.3	Confident	68.8	Low	139 Å²	139	104 Å²	104	65%	0.65	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-63.7	-35.6	-175.4	-57.9	-176.3	23.7	0	0	112.3	H238 I239 L244	H238-Q242 PolarHBondContact O-NE2 3.06Å; H238-Q242 VanDerWaalsContact O-NE2 3.14Å; I239-Q242 PolarHBondContact O-N 2.65Å; Q242-L244 VanDerWaalsContact C-N 3.27Å; Q242-L244 PolarHBondContact O-N 3.22Å
243	T	60.6	Low	66.7	Low	53 Å²	53	109.6 Å²	109.6	33%	0.325	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-64.6	-24.3	-179.6	-23.4	0	0	0	0	114.5	T220 G241 Q245 A246	T220-T243 HydrophobicContact CG2-CG2 4.33Å; T220-T243 VanDerWaalsContact OG1-CB 3.25Å; T220-T243 WeakPolarHBondContact OG1-CB 3.42Å; T220-T243 WeakPolarHBondContact OG1-CG2 3.45Å; T220-T243 PolarHBondContact OG1-OG1 3.31Å; G241-T243 VanDerWaalsContact C-N 3.32Å; G241-T243 PolarHBondContact O-N 3.2Å; T243-Q245 PolarHBondContact O-N 2.72Å; T243-Q245 VanDerWaalsContact O-N 3.13Å; T243-A246 PolarHBondContact O-N 2.86Å
244	L	57.2	Low	64	Low	87 Å²	87	109 Å²	109	46%	0.455	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-65.1	-19.4	-174.2	-74.1	172.6	0	0	0	113.6	G241 Q242 Q248	G241-L244 PolarHBondContact O-N 3.4Å; Q242-L244 VanDerWaalsContact C-N 3.27Å; Q242-L244 PolarHBondContact O-N 3.22Å; L244-Q248 PolarHBondContact O-NE2 3.05Å
245	Q	56.9	Low	61.3	Low	167 Å²	167	108.7 Å²	108.7	78%	0.78	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-83.8	-26.4	175.4	-66.4	-175.9	-11.9	0	0	113	T243	T243-Q245 PolarHBondContact O-N 2.72Å; T243-Q245 VanDerWaalsContact O-N 3.13Å
246	A	52.3	Low	58.8	Low	77 Å²	77	106.2 Å²	106.2	64%	0.636	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-76.6	-31.4	-175.8	0	0	0	0	0	113.3	T243 Q248	T243-A246 PolarHBondContact O-N 2.86Å; A246-Q248 VanDerWaalsContact C-N 3.25Å; A246-Q248 PolarHBondContact O-N 2.84Å
247	Q	51.4	Low	56.2	Low	167 Å²	167	112 Å²	112	78%	0.78	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-76.8	-2.3	-174.3	-152.7	80.4	7.5	0	0	114.4
248	Q	50.9	Low	53.9	Low	151 Å²	151	113.9 Å²	113.9	71%	0.706	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-112.4	-4.4	-168.1	-71.4	-178.4	84.1	0	0	115.2	L244 A246 G250	L244-Q248 PolarHBondContact O-NE2 3.05Å; A246-Q248 VanDerWaalsContact C-N 3.25Å; A246-Q248 PolarHBondContact O-N 2.84Å; Q248-G250 PolarHBondContact O-N 3.46Å
249	Q	43.8	Very low	51.3	Low	196 Å²	196	114.8 Å²	114.8	92%	0.916	68%	0.681	S	S	*	*			trans	-90.5	73.1	172.7	-71.6	-171.1	-13.7	0	0	110.5
250	G	41.7	Very low	49	Very low	64 Å²	64	117.5 Å²	117.5	66%	0.66	70%	0.702	S	S	*	*	S	Bend	trans	-158.9	12.9	-172.3	0	0	0	0	0	117.2	Q248	Q248-G250 PolarHBondContact O-N 3.46Å
251	D	42.2	Very low	46.9	Very low	156 Å²	156	122.4 Å²	122.4	83%	0.834	73%	0.733	S	S	*	*			trans	-175.6	127.2	163.5	-105.3	-32.6	0	0	0	111.5
252	T	33.8	Very low	45	Very low	141 Å²	141	128.3 Å²	128.3	87%	0.865	76%	0.758	S	S	*	*			trans	177.5	140.2	143.4	17.5	0	0	0	0	112.1
253	P	45.8	Very low	43.6	Very low	129 Å²	129	126.8 Å²	126.8	84%	0.838	76%	0.763	S	S	*	*			trans	-90.1	163.5	175.3	36.6	-35.2	0	0	0	113
254	A	34.5	Very low	42.2	Very low	108 Å²	108	128 Å²	128	89%	0.893	79%	0.786	S	S	*	*			trans	-118.9	120.8	-179.7	0	0	0	0	0	113.3
255	D	34.6	Very low	41.1	Very low	156 Å²	156	129.1 Å²	129.1	83%	0.834	81%	0.808	S	S	*	*			trans	-157.9	147.8	169.6	-170.3	47.1	0	0	0	105.8
256	S	37.5	Very low	39.8	Very low	89 Å²	89	124.8 Å²	124.8	62%	0.622	81%	0.808	S	S	*	*			cis	-150.5	167.2	2.4	-145.5	0	0	0	0	109.9
257	S	36.5	Very low	39.3	Very low	127 Å²	127	126.8 Å²	126.8	89%	0.888	82%	0.817	S	S	*	*			trans	-178.9	149.2	138.9	-85.8	0	0	0	0	112.5
258	S	39.7	Very low	39.5	Very low	115 Å²	115	124.2 Å²	124.2	80%	0.804	82%	0.815	S	S	*	*			trans	-127.9	154.8	-174.1	57.7	0	0	0	0	112.6
259	V	36.4	Very low	38.9	Very low	149 Å²	149	124.5 Å²	124.5	90%	0.903	82%	0.818	S	S	*	*			trans	-150.5	136.6	164.2	-97.9	0	0	0	0	110.1
260	T	38.9	Very low	38.4	Very low	137 Å²	137	120.9 Å²	120.9	84%	0.84	81%	0.805	S	S	*	*			trans	-118.4	155.7	170.7	48.8	0	0	0	0	110.2
261	P	44.4	Very low	38.6	Very low	133 Å²	133	123.3 Å²	123.3	86%	0.864	81%	0.807	S	S	*	*				-134.1	172.8	128.7	36.8	-26.8	0	0	0	112.6
262	N	35.3	Very low	39	Very low	153 Å²	153	121.3 Å²	121.3	82%	0.818	80%	0.803	S	S	*	*			trans	-139.8	159.1	-171.6	174.7	45.7	0	0	0	112.6
263	S	40.9	Very low	39.7	Very low	108 Å²	108	120.7 Å²	120.7	76%	0.755	80%	0.801	S	S	*	*			trans	107.8	132.5	163.5	-45.1	0	0	0	0	115.6
264	G	31.5	Very low	39.4	Very low	78 Å²	78	119.7 Å²	119.7	80%	0.804	80%	0.804	S	S	*	*			trans	176.8	-1.9	177.5	0	0	0	0	0	121.8
265	A	34.1	Very low	39.5	Very low	111 Å²	111	119.4 Å²	119.4	92%	0.917	80%	0.801	S	S	*	*			trans	38.8	120.9	165.6	0	0	0	0	0	121.4
266	G	28.8	Very low	39.7	Very low	76 Å²	76	118.3 Å²	118.3	78%	0.784	80%	0.8	S	S	*	*			trans	-176.1	107.9	166.1	0	0	0	0	0	114.6
267	S	42.5	Very low	40.3	Very low	119 Å²	119	120 Å²	120	83%	0.832	81%	0.81	S	S	*	*			trans	-155.8	165	178.3	-64	0	0	0	0	107.7
268	P	55.1	Low	40.3	Very low	113 Å²	113	124.9 Å²	124.9	73%	0.734	81%	0.808	S	S	*	*			cis	-114.3	-163.9	19.4	46.4	-35	0	0	0	112.1
269	M	38.5	Very low	40.1	Very low	157 Å²	157	124.1 Å²	124.1	77%	0.773	80%	0.803	S	S	*	*			cis	-146.4	-179.2	5.9	-134.1	135	84.8	0	0	107.7
270	D	34.3	Very low	40.1	Very low	119 Å²	119	123.3 Å²	123.3	64%	0.636	80%	0.799	S	S	*	*			cis	-147.2	-151.1	15.2	-150.6	-47.8	0	0	0	111.5
271	T	45.2	Very low	40.5	Very low	116 Å²	116	123.1 Å²	123.1	71%	0.712	80%	0.797	S	S	*	*			trans	-144.8	172.8	-165.8	20.5	0	0	0	0	112.1
272	P	50.3	Low	40.7	Very low	114 Å²	114	123 Å²	123	74%	0.74	80%	0.796	S	S	*	*			cis	-132.4	173.1	-24.5	35.5	-18.9	0	0	0	113.9
273	P	49.4	Very low	40.6	Very low	128 Å²	128	119.3 Å²	119.3	83%	0.831	80%	0.795	S	S	*	*			trans	-91.8	165.8	166.5	36.9	-34.2	0	0	0	113.7
274	A	39.1	Very low	40.7	Very low	108 Å²	108	121 Å²	121	89%	0.893	80%	0.8	S	S	*	*			trans	-106.5	162.3	173.3	0	0	0	0	0	112.7
275	A	36.3	Very low	41.6	Very low	102 Å²	102	123.2 Å²	123.2	84%	0.843	80%	0.801	S	S	*	*			trans	-106.7	170.2	-159	0	0	0	0	0	117.2
276	T	39.5	Very low	41.8	Very low	132 Å²	132	122.6 Å²	122.6	81%	0.81	79%	0.79	S	S	*	*			trans	-66.3	173.6	170.3	46.1	0	0	0	0	112.4
277	P	48.9	Very low	42.4	Very low	126 Å²	126	125.1 Å²	125.1	82%	0.818	79%	0.79	S	S	*	*			cis	-151.5	-167.5	39.2	44.6	-20.7	0	0	0	119.9
278	R	38.3	Very low	42.8	Very low	229 Å²	229	127.7 Å²	127.7	86%	0.864	79%	0.793	S	S	*	*			trans	-72.3	159.9	-175.6	-49.5	148.9	78	-163.2	8.8	112.6
279	S	34	Very low	42.2	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	80%	0.796	S	S	*	*				171.1	146.3	109	-75.4	0	0	0	0	116.8
280	T	37.8	Very low	42.4	Very low	132 Å²	132	129.5 Å²	129.5	81%	0.81	80%	0.799	S	S	*	*			trans	58.7	140.7	143.4	52.5	0	0	0	0	124
281	T	46.1	Very low	43	Very low	133 Å²	133	129.5 Å²	129.5	82%	0.816	80%	0.804	S	S	*	*			trans	-73.6	156.5	164.2	34.2	0	0	0	0	114
282	P	48.9	Very low	44	Very low	129 Å²	129	129.5 Å²	129.5	84%	0.838	81%	0.805	S	S	*	*			trans	-103.2	159.5	153.5	6.8	14.5	0	0	0	112.3
283	G	33.1	Very low	43.7	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	83%	0.828	S	S	*	*			trans	-110.8	-168.7	177.8	0	0	0	0	0	114.6
284	T	43.1	Very low	43.4	Very low	143 Å²	143	139.9 Å²	139.9	88%	0.877	83%	0.828	S	S	*	*			trans	-70	151.3	179.6	30.3	0	0	0	0	114.5
285	P	50.8	Low	43.6	Very low	125 Å²	125	141.6 Å²	141.6	81%	0.812	82%	0.824	S	S	*	*			trans	-104.7	161.2	148.9	36.7	-29.4	0	0	0	111.6
286	S	38.7	Very low	44	Very low	99 Å²	99	143.8 Å²	143.8	69%	0.692	82%	0.823	S	S	*	*			trans	-134.1	147.6	175	-176.4	0	0	0	0	110.9
287	T	40	Very low	44.3	Very low	128 Å²	128	144.5 Å²	144.5	79%	0.785	82%	0.824	S	S	*	*			trans	38.7	107.1	152.3	50.5	0	0	0	0	119.1
288	I	51.4	Low	44	Very low	174 Å²	174	145.6 Å²	145.6	89%	0.892	82%	0.824	S	S	*	*			trans	-135.1	135.8	142.9	-44.1	177.8	0	0	0	108.7
289	E	42.8	Very low	44.4	Very low	170 Å²	170	140.1 Å²	140.1	79%	0.794	82%	0.822	S	S	*	*			trans	-96.7	147.9	176.5	174.4	-170.7	124.3	0	0	110.4
290	T	41.8	Very low	45.1	Very low	137 Å²	137	143 Å²	143	84%	0.84	83%	0.831	S	S	*	*			trans	179.5	127.2	143.9	-74.3	0	0	0	0	111
291	T	48.1	Very low	45.7	Very low	119 Å²	119	143.8 Å²	143.8	73%	0.73	83%	0.833	S	S	*	*			trans	-93.1	-170.5	169.5	5.7	0	0	0	0	110.7
292	P	66	Low	45.7	Very low	116 Å²	116	144.8 Å²	144.8	75%	0.753	83%	0.834	S	S	*	*			cis	-127.7	172.2	-31.8	36.5	-22	0	0	0	112.7
293	R	43.4	Very low	45.4	Very low	321 Å²	321	146.2 Å²	146.2	100%	1.211	83%	0.834	S	S	*	*			trans	-155.8	0	134.3	-144.5	178.9	-173.6	-154.6	-0.3	112.2

Retrieved 293 of 293 residues in 53.2 ms (Link to these results)

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